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

Systemtic Name: 3-[4-[(3,5-dimethylphenyl)amino]-2-(1-naphthalen-1-ylethylcarbamoyl)phenyl]propanoic acid Openeye Name: 3-[4-(3,5-dimethylanilino)-2-[1-(1-naphthyl)ethylcarbamoyl]phenyl]propanoic acid CAS Name: 3-[4-(3,5-dimethylanilino)-2-[[1-(1-naphthalenyl)ethylamino]-oxomethyl]phenyl]propanoic acid IUPAC Name: 3-[4-(3,5-dimethylanilino)-2-(1-naphthalen-1-ylethylcarbamoyl)phenyl]propanoic acid Traditional Name: 3-[4-(3,5-dimethylanilino)-2-[1-(1-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=CC=CC4=CC=CC=C43)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC2=CC(=C(C=C2)CCC(=O)O)C(=O)NC(C)C3=CC=CC4=CC=CC=C43)C

InChI

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