methyl (Z)-5-oxidanylidene-5-[[(2S)-1-oxidanylidene-3-phenyl-1-phenylazanyl-propan-2-yl]amino]-2-(phenylmethoxycarbonylamino)pent-2-enoate

Systemtic Name: methyl (Z)-5-oxidanylidene-5-[[(2S)-1-oxidanylidene-3-phenyl-1-phenylazanyl-propan-2-yl]amino]-2-(phenylmethoxycarbonylamino)pent-2-enoate Openeye Name: methyl (Z)-5-[[(1S)-2-anilino-1-benzyl-2-oxo-ethyl]amino]-2-(benzyloxycarbonylamino)-5-oxo-pent-2-enoate CAS Name: (Z)-5-[[(2S)-1-anilino-1-oxo-3-phenylpropan-2-yl]amino]-5-oxo-2-(phenylmethoxycarbonylamino)-2-pentenoic acid methyl ester IUPAC Name: methyl (Z)-5-[[(2S)-1-anilino-1-oxo-3-phenylpropan-2-yl]amino]-5-oxo-2-(phenylmethoxycarbonylamino)pent-2-enoate Traditional Name: (Z)-5-[[(1S)-2-anilino-1-benzyl-2-keto-ethyl]amino]-2-(benzyloxycarbonylamino)-5-keto-pent-2-enoic acid methyl ester Formula: C29H29N3O6 MolecularWeight: 515.55706

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CCC(=O)NC(CC1=CC=CC=C1)C(=O)NC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

COC(=O)/C(=C/CC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NC2=CC=CC=C2)/NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C29H29N3O6/c1-37-28(35)24(32-29(36)38-20-22-13-7-3-8-14-22)17-18-26(33)31-25(19-21-11-5-2-6-12-21)27(34)30-23-15-9-4-10-16-23/h2-17,25H,18-20H2,1H3,(H,30,34)(H,31,33)(H,32,36)/b24-17-/t25-/m0/s1