diethyl (2S)-2-[[4-[(3-chloranyl-2-phenyl-quinoxalin-6-yl)methoxy]phenyl]carbonylamino]pentanedioate

Systemtic Name: diethyl (2S)-2-[[4-[(3-chloranyl-2-phenyl-quinoxalin-6-yl)methoxy]phenyl]carbonylamino]pentanedioate Openeye Name: diethyl (2S)-2-[[4-[(3-chloro-2-phenyl-quinoxalin-6-yl)methoxy]benzoyl]amino]pentanedioate CAS Name: (2S)-2-[[[4-[(3-chloro-2-phenyl-6-quinoxalinyl)methoxy]phenyl]-oxomethyl]amino]pentanedioic acid diethyl ester IUPAC Name: diethyl (2S)-2-[[4-[(3-chloro-2-phenylquinoxalin-6-yl)methoxy]benzoyl]amino]pentanedioate Traditional Name: (2S)-2-[[4-[(3-chloro-2-phenyl-quinoxalin-6-yl)methoxy]benzoyl]amino]glutaric acid diethyl ester Formula: C31H30ClN3O6 MolecularWeight: 576.0394

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(C(=O)OCC)NC(=O)C1=CC=C(C=C1)OCC2=CC3=C(C=C2)N=C(C(=N3)Cl)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)CC[C@@H](C(=O)OCC)NC(=O)C1=CC=C(C=C1)OCC2=CC3=C(C=C2)N=C(C(=N3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C31H30ClN3O6/c1-3-39-27(36)17-16-25(31(38)40-4-2)35-30(37)22-11-13-23(14-12-22)41-19-20-10-15-24-26(18-20)34-29(32)28(33-24)21-8-6-5-7-9-21/h5-15,18,25H,3-4,16-17,19H2,1-2H3,(H,35,37)/t25-/m0/s1