4-chloranyl-3-[[(E)-2-methyl-3-(4-methylphenyl)prop-2-enoyl]amino]benzoic acid

Systemtic Name: 4-chloranyl-3-[[(E)-2-methyl-3-(4-methylphenyl)prop-2-enoyl]amino]benzoic acid Openeye Name: 4-chloro-3-[[(E)-2-methyl-3-(p-tolyl)prop-2-enoyl]amino]benzoic acid CAS Name: 4-chloro-3-[[(E)-2-methyl-3-(4-methylphenyl)-1-oxoprop-2-enyl]amino]benzoic acid IUPAC Name: 4-chloro-3-[[(E)-2-methyl-3-(4-methylphenyl)prop-2-enoyl]amino]benzoic acid Traditional Name: 4-chloro-3-[[(E)-2-methyl-3-(p-tolyl)acryloyl]amino]benzoic acid Formula: C18H16ClNO3 MolecularWeight: 329.77754

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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