3-[[(E)-2-methyl-3-(2-methylphenyl)prop-2-enoyl]amino]benzoic acid

Systemtic Name: 3-[[(E)-2-methyl-3-(2-methylphenyl)prop-2-enoyl]amino]benzoic acid Openeye Name: 3-[[(E)-2-methyl-3-(o-tolyl)prop-2-enoyl]amino]benzoic acid CAS Name: 3-[[(E)-2-methyl-3-(2-methylphenyl)-1-oxoprop-2-enyl]amino]benzoic acid IUPAC Name: 3-[[(E)-2-methyl-3-(2-methylphenyl)prop-2-enoyl]amino]benzoic acid Traditional Name: 3-[[(E)-2-methyl-3-(o-tolyl)acryloyl]amino]benzoic acid Formula: C18H17NO3 MolecularWeight: 295.33248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C=C(C)C(=O)NC2=CC=CC(=C2)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1/C=C(\C)/C(=O)NC2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C18H17NO3/c1-12-6-3-4-7-14(12)10-13(2)17(20)19-16-9-5-8-15(11-16)18(21)22/h3-11H,1-2H3,(H,19,20)(H,21,22)/b13-10+