(phenylmethyl) N-[(1S,2S)-1-(1H-indol-3-yl)-3-oxidanylidene-1-phenyl-3-phenylazanyl-propan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(1S,2S)-1-(1H-indol-3-yl)-3-oxidanylidene-1-phenyl-3-phenylazanyl-propan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-2-anilino-1-[(S)-1H-indol-3-yl(phenyl)methyl]-2-oxo-ethyl]carbamate CAS Name: N-[(2S,3S)-1-anilino-3-(1H-indol-3-yl)-1-oxo-3-phenylpropan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S,3S)-1-anilino-3-(1H-indol-3-yl)-1-oxo-3-phenylpropan-2-yl]carbamate Traditional Name: N-[(1S)-2-anilino-1-[(S)-1H-indol-3-yl(phenyl)methyl]-2-keto-ethyl]carbamic acid benzyl ester Formula: C31H27N3O3 MolecularWeight: 489.56438

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(C(C2=CC=CC=C2)C3=CNC4=CC=CC=C43)C(=O)NC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)N[C@@H]([C@@H](C2=CC=CC=C2)C3=CNC4=CC=CC=C43)C(=O)NC5=CC=CC=C5

InChI

InChI=1S/C31H27N3O3/c35-30(33-24-16-8-3-9-17-24)29(34-31(36)37-21-22-12-4-1-5-13-22)28(23-14-6-2-7-15-23)26-20-32-27-19-11-10-18-25(26)27/h1-20,28-29,32H,21H2,(H,33,35)(H,34,36)/t28-,29-/m0/s1