3-[[2-(2-methoxyethoxy)-5-(phenylmethoxycarbonylamino)phenyl]carbonylamino]-3-phenyl-propanoic acid

Systemtic Name: 3-[[2-(2-methoxyethoxy)-5-(phenylmethoxycarbonylamino)phenyl]carbonylamino]-3-phenyl-propanoic acid Openeye Name: 3-[[5-(benzyloxycarbonylamino)-2-(2-methoxyethoxy)benzoyl]amino]-3-phenyl-propanoic acid CAS Name: 3-[[[2-(2-methoxyethoxy)-5-(phenylmethoxycarbonylamino)phenyl]-oxomethyl]amino]-3-phenylpropanoic acid IUPAC Name: 3-[[2-(2-methoxyethoxy)-5-(phenylmethoxycarbonylamino)benzoyl]amino]-3-phenylpropanoic acid Traditional Name: 3-[[5-(benzyloxycarbonylamino)-2-(2-methoxyethoxy)benzoyl]amino]-3-phenyl-propionic acid Formula: C27H28N2O7 MolecularWeight: 492.52042

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(C=C(C=C1)NC(=O)OCC2=CC=CC=C2)C(=O)NC(CC(=O)O)C3=CC=CC=C3

Isomeric SMILES

COCCOC1=C(C=C(C=C1)NC(=O)OCC2=CC=CC=C2)C(=O)NC(CC(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C27H28N2O7/c1-34-14-15-35-24-13-12-21(28-27(33)36-18-19-8-4-2-5-9-19)16-22(24)26(32)29-23(17-25(30)31)20-10-6-3-7-11-20/h2-13,16,23H,14-15,17-18H2,1H3,(H,28,33)(H,29,32)(H,30,31)