4-methoxy-2-methyl-5-(2-naphthalen-1-ylbutanoylamino)-3-phenyl-benzoic acid

Systemtic Name: 4-methoxy-2-methyl-5-(2-naphthalen-1-ylbutanoylamino)-3-phenyl-benzoic acid Openeye Name: 4-methoxy-2-methyl-5-[2-(1-naphthyl)butanoylamino]-3-phenyl-benzoic acid CAS Name: 4-methoxy-2-methyl-5-[[2-(1-naphthalenyl)-1-oxobutyl]amino]-3-phenylbenzoic acid IUPAC Name: 4-methoxy-2-methyl-5-(2-naphthalen-1-ylbutanoylamino)-3-phenylbenzoic acid Traditional Name: 4-methoxy-2-methyl-5-[2-(1-naphthyl)butanoylamino]-3-phenyl-benzoic acid Formula: C29H27NO4 MolecularWeight: 453.52898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC2=CC=CC=C21)C(=O)NC3=C(C(=C(C(=C3)C(=O)O)C)C4=CC=CC=C4)OC

Isomeric SMILES

CCC(C1=CC=CC2=CC=CC=C21)C(=O)NC3=C(C(=C(C(=C3)C(=O)O)C)C4=CC=CC=C4)OC

InChI

InChI=1S/C29H27NO4/c1-4-21(23-16-10-14-19-11-8-9-15-22(19)23)28(31)30-25-17-24(29(32)33)18(2)26(27(25)34-3)20-12-6-5-7-13-20/h5-17,21H,4H2,1-3H3,(H,30,31)(H,32,33)