4-cyano-3-cyclopropyl-2-methyl-6-(2-naphthalen-1-ylpropanoylamino)-5-phenyl-benzoic acid

Systemtic Name: 4-cyano-3-cyclopropyl-2-methyl-6-(2-naphthalen-1-ylpropanoylamino)-5-phenyl-benzoic acid Openeye Name: 4-cyano-3-cyclopropyl-2-methyl-6-[2-(1-naphthyl)propanoylamino]-5-phenyl-benzoic acid CAS Name: 4-cyano-3-cyclopropyl-2-methyl-6-[[2-(1-naphthalenyl)-1-oxopropyl]amino]-5-phenylbenzoic acid IUPAC Name: 4-cyano-3-cyclopropyl-2-methyl-6-(2-naphthalen-1-ylpropanoylamino)-5-phenylbenzoic acid Traditional Name: 4-cyano-3-cyclopropyl-2-methyl-6-[2-(1-naphthyl)propanoylamino]-5-phenyl-benzoic acid Formula: C31H26N2O3 MolecularWeight: 474.54974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1C(=O)O)NC(=O)C(C)C2=CC=CC3=CC=CC=C32)C4=CC=CC=C4)C#N)C5CC5

Isomeric SMILES

CC1=C(C(=C(C(=C1C(=O)O)NC(=O)C(C)C2=CC=CC3=CC=CC=C32)C4=CC=CC=C4)C#N)C5CC5

InChI

InChI=1S/C31H26N2O3/c1-18(23-14-8-12-20-9-6-7-13-24(20)23)30(34)33-29-27(31(35)36)19(2)26(22-15-16-22)25(17-32)28(29)21-10-4-3-5-11-21/h3-14,18,22H,15-16H2,1-2H3,(H,33,34)(H,35,36)