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

Systemtic Name: 2-[[2-[(4-methyl-2-naphthalen-1-yl-pentanoyl)amino]-4-(pyrazol-1-ylmethyl)phenyl]methyl]benzoic acid Openeye Name: 2-[[2-[[4-methyl-2-(1-naphthyl)pentanoyl]amino]-4-(pyrazol-1-ylmethyl)phenyl]methyl]benzoic acid CAS Name: 2-[[2-[[4-methyl-2-(1-naphthalenyl)-1-oxopentyl]amino]-4-(1-pyrazolylmethyl)phenyl]methyl]benzoic acid IUPAC Name: 2-[[2-[(4-methyl-2-naphthalen-1-ylpentanoyl)amino]-4-(pyrazol-1-ylmethyl)phenyl]methyl]benzoic acid Traditional Name: 2-[2-[[4-methyl-2-(1-naphthyl)pentanoyl]amino]-4-(pyrazol-1-ylmethyl)benzyl]benzoic acid Formula: C34H33N3O3 MolecularWeight: 531.64412

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=CC2=CC=CC=C21)C(=O)NC3=C(C=CC(=C3)CN4C=CC=N4)CC5=CC=CC=C5C(=O)O

Isomeric SMILES

CC(C)CC(C1=CC=CC2=CC=CC=C21)C(=O)NC3=C(C=CC(=C3)CN4C=CC=N4)CC5=CC=CC=C5C(=O)O

InChI

InChI=1S/C34H33N3O3/c1-23(2)19-31(30-14-7-11-25-9-3-5-12-28(25)30)33(38)36-32-20-24(22-37-18-8-17-35-37)15-16-27(32)21-26-10-4-6-13-29(26)34(39)40/h3-18,20,23,31H,19,21-22H2,1-2H3,(H,36,38)(H,39,40)