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

Systemtic Name: 5-chloranyl-2-[[(E)-2-methyl-3-(2-methylphenyl)prop-2-enoyl]amino]benzoic acid Openeye Name: 5-chloro-2-[[(E)-2-methyl-3-(o-tolyl)prop-2-enoyl]amino]benzoic acid CAS Name: 5-chloro-2-[[(E)-2-methyl-3-(2-methylphenyl)-1-oxoprop-2-enyl]amino]benzoic acid IUPAC Name: 5-chloro-2-[[(E)-2-methyl-3-(2-methylphenyl)prop-2-enoyl]amino]benzoic acid Traditional Name: 5-chloro-2-[[(E)-2-methyl-3-(o-tolyl)acryloyl]amino]benzoic acid Formula: C18H16ClNO3 MolecularWeight: 329.77754

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16ClNO3/c1-11-5-3-4-6-13(11)9-12(2)17(21)20-16-8-7-14(19)10-15(16)18(22)23/h3-10H,1-2H3,(H,20,21)(H,22,23)/b12-9+