2-[[4-[(3-benzamidophenoxy)methyl]phenyl]methoxycarbonylamino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[4-[(3-benzamidophenoxy)methyl]phenyl]methoxycarbonylamino]-3-phenyl-propanoic acid Openeye Name: 2-[[4-[(3-benzamidophenoxy)methyl]phenyl]methoxycarbonylamino]-3-phenyl-propanoic acid CAS Name: 2-[[[4-[(3-benzamidophenoxy)methyl]phenyl]methoxy-oxomethyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[4-[(3-benzamidophenoxy)methyl]phenyl]methoxycarbonylamino]-3-phenylpropanoic acid Traditional Name: 2-[[4-[(3-benzamidophenoxy)methyl]benzyl]oxycarbonylamino]-3-phenyl-propionic acid Formula: C31H28N2O6 MolecularWeight: 524.56382

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)NC(=O)OCC2=CC=C(C=C2)COC3=CC=CC(=C3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)O)NC(=O)OCC2=CC=C(C=C2)COC3=CC=CC(=C3)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C31H28N2O6/c34-29(25-10-5-2-6-11-25)32-26-12-7-13-27(19-26)38-20-23-14-16-24(17-15-23)21-39-31(37)33-28(30(35)36)18-22-8-3-1-4-9-22/h1-17,19,28H,18,20-21H2,(H,32,34)(H,33,37)(H,35,36)