[2-[[3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]ethanoylamino] benzoate

Systemtic Name: [2-[[3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]ethanoylamino] benzoate Openeye Name: [[2-[[2-(benzyloxycarbonylamino)-3-phenyl-propanoyl]amino]acetyl]amino] benzoate CAS Name: benzoic acid [[1-oxo-2-[[1-oxo-3-phenyl-2-(phenylmethoxycarbonylamino)propyl]amino]ethyl]amino] ester IUPAC Name: [[2-[[3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]acetyl]amino] benzoate Traditional Name: benzoic acid [[2-[[2-(benzyloxycarbonylamino)-3-phenyl-propanoyl]amino]acetyl]amino] ester Formula: C26H25N3O6 MolecularWeight: 475.4932

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NCC(=O)NOC(=O)C2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)NCC(=O)NOC(=O)C2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C26H25N3O6/c30-23(29-35-25(32)21-14-8-3-9-15-21)17-27-24(31)22(16-19-10-4-1-5-11-19)28-26(33)34-18-20-12-6-2-7-13-20/h1-15,22H,16-18H2,(H,27,31)(H,28,33)(H,29,30)