methyl (2S)-2-(phenylmethoxycarbonylamino)-6-[(phenylmethylidene)amino]hexanoate

Systemtic Name: methyl (2S)-2-(phenylmethoxycarbonylamino)-6-[(phenylmethylidene)amino]hexanoate Openeye Name: methyl (2S)-6-(benzylideneamino)-2-(benzyloxycarbonylamino)hexanoate CAS Name: (2S)-2-(phenylmethoxycarbonylamino)-6-[(phenylmethylene)amino]hexanoic acid methyl ester IUPAC Name: methyl (2S)-6-(benzylideneamino)-2-(phenylmethoxycarbonylamino)hexanoate Traditional Name: (2S)-6-(benzalamino)-2-(benzyloxycarbonylamino)hexanoic acid methyl ester Formula: C22H26N2O4 MolecularWeight: 382.45284

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCCCN=CC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

COC(=O)[C@H](CCCCN=CC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C22H26N2O4/c1-27-21(25)20(24-22(26)28-17-19-12-6-3-7-13-19)14-8-9-15-23-16-18-10-4-2-5-11-18/h2-7,10-13,16,20H,8-9,14-15,17H2,1H3,(H,24,26)/t20-/m0/s1