Benzeneacetic acid, α-hydroxy-, (αS)-, compd. with 4-methoxy-α-methyl-N-(phenylmethyl)benzeneethanamine (1:1)
CAS Registry Number®
245759-64-2
CAS Name
Benzeneacetic acid, α-hydroxy-, (αS)-, compd. with 4-methoxy-α-methyl-N-(phenylmethyl)benzeneethanamine (1:1)Molecular Formula
C17H21NO.C8H8O3Cite this Page
Benzeneacetic acid, α-hydroxy-, (αS)-, compd. with 4-methoxy-α-methyl-N-(phenylmethyl)benzeneethanamine (1:1). CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=245759-64-2 (retrieved ) (CAS RN: 245759-64-2). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C17H21NO.C8H8O3/c1-14(18-13-16-6-4-3-5-7-16)12-15-8-10-17(19-2)11-9-15;9-7(8(10)11)6-4-2-1-3-5-6/h3-11,14,18H,12-13H2,1-2H3;1-5,7,9H,(H,10,11)/t;7-/m.0/s1
InChIKey
InChIKey=PDWPSGIFFIAUNQ-ZLTKDMPESA-N
SMILES
C(C(NCC1=CC=CC=C1)C)C2=CC=C(OC)C=C2.[C@H](C(O)=O)(O)C1=CC=CC=C1
Canonical SMILES
O=C(O)C(O)C=1C=CC=CC1.O(C1=CC=C(C=C1)CC(NCC=2C=CC=CC2)C)C
Other Names for this Substance
- Benzeneacetic acid, α-hydroxy-, (αS)-, compd. with 4-methoxy-α-methyl-N-(phenylmethyl)benzeneethanamine (1:1)
- Benzeneethanamine, 4-methoxy-α-methyl-N-(phenylmethyl)-, (αS)-α-hydroxybenzeneacetate