2-[[(E)-3-(6-methylnaphthalen-2-yl)but-2-enoyl]amino]benzoic acid

Systemtic Name: 2-[[(E)-3-(6-methylnaphthalen-2-yl)but-2-enoyl]amino]benzoic acid Openeye Name: 2-[[(E)-3-(6-methyl-2-naphthyl)but-2-enoyl]amino]benzoic acid CAS Name: 2-[[(E)-3-(6-methyl-2-naphthalenyl)-1-oxobut-2-enyl]amino]benzoic acid IUPAC Name: 2-[[(E)-3-(6-methylnaphthalen-2-yl)but-2-enoyl]amino]benzoic acid Traditional Name: 2-[[(E)-3-(6-methyl-2-naphthyl)but-2-enoyl]amino]benzoic acid Formula: C22H19NO3 MolecularWeight: 345.39116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C=C(C=C2)C(=CC(=O)NC3=CC=CC=C3C(=O)O)C

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(C=C2)/C(=C/C(=O)NC3=CC=CC=C3C(=O)O)/C

InChI

InChI=1S/C22H19NO3/c1-14-7-8-18-13-16(9-10-17(18)11-14)15(2)12-21(24)23-20-6-4-3-5-19(20)22(25)26/h3-13H,1-2H3,(H,23,24)(H,25,26)/b15-12+