(phenylmethyl) 4-(benzotriazol-1-yl)-4-oxidanylidene-3-[[3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]butanoate

Systemtic Name: (phenylmethyl) 4-(benzotriazol-1-yl)-4-oxidanylidene-3-[[3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]butanoate Openeye Name: benzyl 4-(benzotriazol-1-yl)-3-[[2-(benzyloxycarbonylamino)-3-phenyl-propanoyl]amino]-4-oxo-butanoate CAS Name: 4-(1-benzotriazolyl)-4-oxo-3-[[1-oxo-3-phenyl-2-(phenylmethoxycarbonylamino)propyl]amino]butanoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-(benzotriazol-1-yl)-4-oxo-3-[[3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]butanoate Traditional Name: 4-(benzotriazol-1-yl)-3-[[2-(benzyloxycarbonylamino)-3-phenyl-propanoyl]amino]-4-keto-butyric acid benzyl ester Formula: C34H31N5O6 MolecularWeight: 605.63984

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NC(CC(=O)OCC2=CC=CC=C2)C(=O)N3C4=CC=CC=C4N=N3)NC(=O)OCC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)NC(CC(=O)OCC2=CC=CC=C2)C(=O)N3C4=CC=CC=C4N=N3)NC(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C34H31N5O6/c40-31(44-22-25-14-6-2-7-15-25)21-29(33(42)39-30-19-11-10-18-27(30)37-38-39)35-32(41)28(20-24-12-4-1-5-13-24)36-34(43)45-23-26-16-8-3-9-17-26/h1-19,28-29H,20-23H2,(H,35,41)(H,36,43)