(E)-3-(2-azanyl-5-methyl-phenyl)-3-(4-bromophenyl)prop-2-enoic acid

Systemtic Name: (E)-3-(2-azanyl-5-methyl-phenyl)-3-(4-bromophenyl)prop-2-enoic acid Openeye Name: (E)-3-(2-amino-5-methyl-phenyl)-3-(4-bromophenyl)prop-2-enoic acid CAS Name: (E)-3-(2-amino-5-methylphenyl)-3-(4-bromophenyl)-2-propenoic acid IUPAC Name: (E)-3-(2-amino-5-methylphenyl)-3-(4-bromophenyl)prop-2-enoic acid Traditional Name: (E)-3-(2-amino-5-methyl-phenyl)-3-(4-bromophenyl)acrylic acid Formula: C16H14BrNO2 MolecularWeight: 332.19186

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14BrNO2/c1-10-2-7-15(18)14(8-10)13(9-16(19)20)11-3-5-12(17)6-4-11/h2-9H,18H2,1H3,(H,19,20)/b13-9+