2-(3-naphthalen-2-ylbutanoylamino)benzoic acid

Systemtic Name: 2-(3-naphthalen-2-ylbutanoylamino)benzoic acid Openeye Name: 2-[3-(2-naphthyl)butanoylamino]benzoic acid CAS Name: 2-[[3-(2-naphthalenyl)-1-oxobutyl]amino]benzoic acid IUPAC Name: 2-(3-naphthalen-2-ylbutanoylamino)benzoic acid Traditional Name: 2-[3-(2-naphthyl)butanoylamino]benzoic acid Formula: C21H19NO3 MolecularWeight: 333.38046

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NC1=CC=CC=C1C(=O)O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CC(CC(=O)NC1=CC=CC=C1C(=O)O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C21H19NO3/c1-14(16-11-10-15-6-2-3-7-17(15)13-16)12-20(23)22-19-9-5-4-8-18(19)21(24)25/h2-11,13-14H,12H2,1H3,(H,22,23)(H,24,25)