2-[[2-[(4-methyl-2-naphthalen-1-yl-pentanoyl)amino]phenyl]methyl]benzoic acid

Systemtic Name: 2-[[2-[(4-methyl-2-naphthalen-1-yl-pentanoyl)amino]phenyl]methyl]benzoic acid Openeye Name: 2-[[2-[[4-methyl-2-(1-naphthyl)pentanoyl]amino]phenyl]methyl]benzoic acid CAS Name: 2-[[2-[[4-methyl-2-(1-naphthalenyl)-1-oxopentyl]amino]phenyl]methyl]benzoic acid IUPAC Name: 2-[[2-[(4-methyl-2-naphthalen-1-ylpentanoyl)amino]phenyl]methyl]benzoic acid Traditional Name: 2-[2-[[4-methyl-2-(1-naphthyl)pentanoyl]amino]benzyl]benzoic acid Formula: C30H29NO3 MolecularWeight: 451.55616

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=CC2=CC=CC=C21)C(=O)NC3=CC=CC=C3CC4=CC=CC=C4C(=O)O

Isomeric SMILES

CC(C)CC(C1=CC=CC2=CC=CC=C21)C(=O)NC3=CC=CC=C3CC4=CC=CC=C4C(=O)O

InChI

InChI=1S/C30H29NO3/c1-20(2)18-27(26-16-9-13-21-10-3-6-14-24(21)26)29(32)31-28-17-8-5-12-23(28)19-22-11-4-7-15-25(22)30(33)34/h3-17,20,27H,18-19H2,1-2H3,(H,31,32)(H,33,34)