(S)-1,1-Dimethylethyl 3-amino-2-oxo-2,3,4,5-tetrahydro-1H-benz[b]azepin-1-acetate

CAS Registry Number®

109010-60-8

CAS Name

(S)-1,1-Dimethylethyl 3-amino-2-oxo-2,3,4,5-tetrahydro-1H-benz[b]azepin-1-acetate

Molecular Formula

C16H22N2O3

Molecular Mass

290.36

Cite this Page

(S)-1,1-Dimethylethyl 3-amino-2-oxo-2,3,4,5-tetrahydro-1H-benz[b]azepin-1-acetate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=109010-60-8 (retrieved 2024-11-28) (CAS RN: 109010-60-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    110-111 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C16H22N2O3/c1-16(2,3)21-14(19)10-18-13-7-5-4-6-11(13)8-9-12(17)15(18)20/h4-7,12H,8-10,17H2,1-3H3/t12-/m0/s1

InChIKey

InChIKey=QTEDVVHLTMELTB-LBPRGKRZSA-N

SMILES

C(C(OC(C)(C)C)=O)N1C=2C(CC[C@H](N)C1=O)=CC=CC2

Canonical SMILES

O=C(OC(C)(C)C)CN1C(=O)C(N)CCC=2C=CC=CC21

Other Names for this Substance

  • 1H-1-Benzazepine-1-acetic acid, 3-amino-2,3,4,5-tetrahydro-2-oxo-, 1,1-dimethylethyl ester, (3S)-
  • 1H-1-Benzazepine-1-acetic acid, 3-amino-2,3,4,5-tetrahydro-2-oxo-, 1,1-dimethylethyl ester, (S)-
  • (S)-1,1-Dimethylethyl 3-amino-2-oxo-2,3,4,5-tetrahydro-1H-benz[b]azepin-1-acetate
  • (S)-1-[(tert-Butyloxycarbonyl)methyl]-3-amino-2,3,4,5-tetrahydro-1H-[1]benzazepin-2-one

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