methyl 2-[[(2S)-2-[(2-benzamidophenyl)carbonylamino]-3-phenyl-propanoyl]amino]benzoate

Systemtic Name: methyl 2-[[(2S)-2-[(2-benzamidophenyl)carbonylamino]-3-phenyl-propanoyl]amino]benzoate Openeye Name: methyl 2-[[(2S)-2-[(2-benzamidobenzoyl)amino]-3-phenyl-propanoyl]amino]benzoate CAS Name: 2-[[(2S)-2-[[(2-benzamidophenyl)-oxomethyl]amino]-1-oxo-3-phenylpropyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[(2S)-2-[(2-benzamidobenzoyl)amino]-3-phenylpropanoyl]amino]benzoate Traditional Name: 2-[[(2S)-2-[(2-benzamidobenzoyl)amino]-3-phenyl-propanoyl]amino]benzoic acid methyl ester Formula: C31H27N3O5 MolecularWeight: 521.56318

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)C(CC2=CC=CC=C2)NC(=O)C3=CC=CC=C3NC(=O)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)C3=CC=CC=C3NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C31H27N3O5/c1-39-31(38)24-17-9-11-19-26(24)33-30(37)27(20-21-12-4-2-5-13-21)34-29(36)23-16-8-10-18-25(23)32-28(35)22-14-6-3-7-15-22/h2-19,27H,20H2,1H3,(H,32,35)(H,33,37)(H,34,36)/t27-/m0/s1