3-[4-[(3,5-dimethylphenyl)amino]-2-(1-naphthalen-2-ylethylcarbamoyl)phenyl]propanoic acid

Systemtic Name: 3-[4-[(3,5-dimethylphenyl)amino]-2-(1-naphthalen-2-ylethylcarbamoyl)phenyl]propanoic acid Openeye Name: 3-[4-(3,5-dimethylanilino)-2-[1-(2-naphthyl)ethylcarbamoyl]phenyl]propanoic acid CAS Name: 3-[4-(3,5-dimethylanilino)-2-[[1-(2-naphthalenyl)ethylamino]-oxomethyl]phenyl]propanoic acid IUPAC Name: 3-[4-(3,5-dimethylanilino)-2-(1-naphthalen-2-ylethylcarbamoyl)phenyl]propanoic acid Traditional Name: 3-[4-(3,5-dimethylanilino)-2-[1-(2-naphthyl)ethylcarbamoyl]phenyl]propionic acid Formula: C30H30N2O3 MolecularWeight: 466.5708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC2=CC(=C(C=C2)CCC(=O)O)C(=O)NC(C)C3=CC4=CC=CC=C4C=C3)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC2=CC(=C(C=C2)CCC(=O)O)C(=O)NC(C)C3=CC4=CC=CC=C4C=C3)C

InChI

InChI=1S/C30H30N2O3/c1-19-14-20(2)16-27(15-19)32-26-12-10-23(11-13-29(33)34)28(18-26)30(35)31-21(3)24-9-8-22-6-4-5-7-25(22)17-24/h4-10,12,14-18,21,32H,11,13H2,1-3H3,(H,31,35)(H,33,34)