2-(2,2-diphenylethanoylamino)-3-[3-methoxy-2-(4-nitrophenoxy)phenyl]propanoic acid

Systemtic Name: 2-(2,2-diphenylethanoylamino)-3-[3-methoxy-2-(4-nitrophenoxy)phenyl]propanoic acid Openeye Name: 2-[(2,2-diphenylacetyl)amino]-3-[3-methoxy-2-(4-nitrophenoxy)phenyl]propanoic acid CAS Name: 3-[3-methoxy-2-(4-nitrophenoxy)phenyl]-2-[(1-oxo-2,2-diphenylethyl)amino]propanoic acid IUPAC Name: 2-[(2,2-diphenylacetyl)amino]-3-[3-methoxy-2-(4-nitrophenoxy)phenyl]propanoic acid Traditional Name: 2-[(2,2-diphenylacetyl)amino]-3-[3-methoxy-2-(4-nitrophenoxy)phenyl]propionic acid Formula: C30H26N2O7 MolecularWeight: 526.53664

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC2=CC=C(C=C2)[N+](=O)[O-])CC(C(=O)O)NC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1OC2=CC=C(C=C2)[N+](=O)[O-])CC(C(=O)O)NC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C30H26N2O7/c1-38-26-14-8-13-22(28(26)39-24-17-15-23(16-18-24)32(36)37)19-25(30(34)35)31-29(33)27(20-9-4-2-5-10-20)21-11-6-3-7-12-21/h2-18,25,27H,19H2,1H3,(H,31,33)(H,34,35)