2-[[2-(2-naphthalen-1-ylbutanoylamino)phenyl]methyl]benzoic acid

Systemtic Name: 2-[[2-(2-naphthalen-1-ylbutanoylamino)phenyl]methyl]benzoic acid Openeye Name: 2-[[2-[2-(1-naphthyl)butanoylamino]phenyl]methyl]benzoic acid CAS Name: 2-[[2-[[2-(1-naphthalenyl)-1-oxobutyl]amino]phenyl]methyl]benzoic acid IUPAC Name: 2-[[2-(2-naphthalen-1-ylbutanoylamino)phenyl]methyl]benzoic acid Traditional Name: 2-[2-[2-(1-naphthyl)butanoylamino]benzyl]benzoic acid Formula: C28H25NO3 MolecularWeight: 423.503

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H25NO3/c1-2-22(25-16-9-13-19-10-3-6-14-23(19)25)27(30)29-26-17-8-5-12-21(26)18-20-11-4-7-15-24(20)28(31)32/h3-17,22H,2,18H2,1H3,(H,29,30)(H,31,32)