[2-[[3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]ethanoylamino] 4-methoxybenzoate

Systemtic Name: [2-[[3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]ethanoylamino] 4-methoxybenzoate Openeye Name: [[2-[[2-(benzyloxycarbonylamino)-3-phenyl-propanoyl]amino]acetyl]amino] 4-methoxybenzoate CAS Name: 4-methoxybenzoic 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] 4-methoxybenzoate Traditional Name: 4-methoxybenzoic acid [[2-[[2-(benzyloxycarbonylamino)-3-phenyl-propanoyl]amino]acetyl]amino] ester Formula: C27H27N3O7 MolecularWeight: 505.51918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)ONC(=O)CNC(=O)C(CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)ONC(=O)CNC(=O)C(CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C27H27N3O7/c1-35-22-14-12-21(13-15-22)26(33)37-30-24(31)17-28-25(32)23(16-19-8-4-2-5-9-19)29-27(34)36-18-20-10-6-3-7-11-20/h2-15,23H,16-18H2,1H3,(H,28,32)(H,29,34)(H,30,31)