Elvitegravir

CAS Registry Number®

697761-98-1
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CAS Name

Elvitegravir

Molecular Formula

C23H23ClFNO5

Molecular Mass

447.88

Cite this Page

Elvitegravir.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=697761-98-1 (retrieved 2024-04-19) (CAS RN: 697761-98-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    151-152 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C23H23ClFNO5/c1-12(2)19(11-27)26-10-16(23(29)30)22(28)15-8-14(20(31-3)9-18(15)26)7-13-5-4-6-17(24)21(13)25/h4-6,8-10,12,19,27H,7,11H2,1-3H3,(H,29,30)/t19-/m1/s1

InChIKey

InChIKey=JUZYLCPPVHEVSV-LJQANCHMSA-N

SMILES

[C@H](C(C)C)(CO)N1C=2C(=CC(CC3=C(F)C(Cl)=CC=C3)=C(OC)C2)C(=O)C(C(O)=O)=C1

Canonical SMILES

O=C(O)C1=CN(C2=CC(OC)=C(C=C2C1=O)CC=3C=CC=C(Cl)C3F)C(CO)C(C)C

Other Names for this Substance

  • 3-Quinolinecarboxylic acid, 6-[(3-chloro-2-fluorophenyl)methyl]-1,4-dihydro-1-[(1S)-1-(hydroxymethyl)-2-methylpropyl]-7-methoxy-4-oxo-
  • 6-[(3-Chloro-2-fluorophenyl)methyl]-1,4-dihydro-1-[(1S)-1-(hydroxymethyl)-2-methylpropyl]-7-methoxy-4-oxo-3-quinolinecarboxylic acid
  • 1,4-Dihydro-6-(3-chloro-2-fluorobenzyl)-7-methoxy-1-[(1S)-1-(hydroxymethyl)-2-methylpropyl]-4-oxo-3-quinolinecarboxylic acid
  • JTK 303
  • GS 9137

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