2-[(2,4-dichlorophenyl)carbonyl-[(3-methoxycarbonylphenyl)methyl]amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[(2,4-dichlorophenyl)carbonyl-[(3-methoxycarbonylphenyl)methyl]amino]-3-phenyl-propanoic acid Openeye Name: 2-[(2,4-dichlorobenzoyl)-[(3-methoxycarbonylphenyl)methyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[(2,4-dichlorophenyl)-oxomethyl]-[(3-methoxycarbonylphenyl)methyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[(2,4-dichlorobenzoyl)-[(3-methoxycarbonylphenyl)methyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[(3-carbomethoxybenzyl)-(2,4-dichlorobenzoyl)amino]-3-phenyl-propionic acid Formula: C25H21Cl2NO5 MolecularWeight: 486.34394

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)CN(C(CC2=CC=CC=C2)C(=O)O)C(=O)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)CN(C(CC2=CC=CC=C2)C(=O)O)C(=O)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C25H21Cl2NO5/c1-33-25(32)18-9-5-8-17(12-18)15-28(23(29)20-11-10-19(26)14-21(20)27)22(24(30)31)13-16-6-3-2-4-7-16/h2-12,14,22H,13,15H2,1H3,(H,30,31)