2-methyl-4-(2-naphthalen-1-ylhexanoylamino)-3-phenyl-benzoic acid

Systemtic Name: 2-methyl-4-(2-naphthalen-1-ylhexanoylamino)-3-phenyl-benzoic acid Openeye Name: 2-methyl-4-[2-(1-naphthyl)hexanoylamino]-3-phenyl-benzoic acid CAS Name: 2-methyl-4-[[2-(1-naphthalenyl)-1-oxohexyl]amino]-3-phenylbenzoic acid IUPAC Name: 2-methyl-4-(2-naphthalen-1-ylhexanoylamino)-3-phenylbenzoic acid Traditional Name: 2-methyl-4-[2-(1-naphthyl)hexanoylamino]-3-phenyl-benzoic acid Formula: C30H29NO3 MolecularWeight: 451.55616

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H29NO3/c1-3-4-15-26(25-17-10-14-21-11-8-9-16-24(21)25)29(32)31-27-19-18-23(30(33)34)20(2)28(27)22-12-6-5-7-13-22/h5-14,16-19,26H,3-4,15H2,1-2H3,(H,31,32)(H,33,34)