4-[[(E)-3-(2-bromanyl-4-methyl-phenyl)prop-2-enoyl]amino]-3-methyl-benzoic acid

Systemtic Name: 4-[[(E)-3-(2-bromanyl-4-methyl-phenyl)prop-2-enoyl]amino]-3-methyl-benzoic acid Openeye Name: 4-[[(E)-3-(2-bromo-4-methyl-phenyl)prop-2-enoyl]amino]-3-methyl-benzoic acid CAS Name: 4-[[(E)-3-(2-bromo-4-methylphenyl)-1-oxoprop-2-enyl]amino]-3-methylbenzoic acid IUPAC Name: 4-[[(E)-3-(2-bromo-4-methylphenyl)prop-2-enoyl]amino]-3-methylbenzoic acid Traditional Name: 4-[[(E)-3-(2-bromo-4-methyl-phenyl)acryloyl]amino]-3-methyl-benzoic acid Formula: C18H16BrNO3 MolecularWeight: 374.22854

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16BrNO3/c1-11-3-4-13(15(19)9-11)6-8-17(21)20-16-7-5-14(18(22)23)10-12(16)2/h3-10H,1-2H3,(H,20,21)(H,22,23)/b8-6+