2-[3-(6-methoxynaphthalen-2-yl)butanoylamino]benzoic acid

Systemtic Name: 2-[3-(6-methoxynaphthalen-2-yl)butanoylamino]benzoic acid Openeye Name: 2-[3-(6-methoxy-2-naphthyl)butanoylamino]benzoic acid CAS Name: 2-[[3-(6-methoxy-2-naphthalenyl)-1-oxobutyl]amino]benzoic acid IUPAC Name: 2-[3-(6-methoxynaphthalen-2-yl)butanoylamino]benzoic acid Traditional Name: 2-[3-(6-methoxy-2-naphthyl)butanoylamino]benzoic acid Formula: C22H21NO4 MolecularWeight: 363.40644

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NC1=CC=CC=C1C(=O)O)C2=CC3=C(C=C2)C=C(C=C3)OC

Isomeric SMILES

CC(CC(=O)NC1=CC=CC=C1C(=O)O)C2=CC3=C(C=C2)C=C(C=C3)OC

InChI

InChI=1S/C22H21NO4/c1-14(11-21(24)23-20-6-4-3-5-19(20)22(25)26)15-7-8-17-13-18(27-2)10-9-16(17)12-15/h3-10,12-14H,11H2,1-2H3,(H,23,24)(H,25,26)