[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl] (E)-but-2-enoate

Systemtic Name: [2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl] (E)-but-2-enoate Openeye Name: [2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl] (E)-but-2-enoate CAS Name: (E)-2-butenoic acid [2-(4-bromo-2-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-bromo-2-methylanilino)-2-oxoethyl] (E)-but-2-enoate Traditional Name: (E)-but-2-enoic acid [2-(4-bromo-2-methyl-anilino)-2-keto-ethyl] ester Formula: C13H14BrNO3 MolecularWeight: 312.15916

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)OCC(=O)NC1=C(C=C(C=C1)Br)C

Isomeric SMILES

C/C=C/C(=O)OCC(=O)NC1=C(C=C(C=C1)Br)C

InChI

InChI=1S/C13H14BrNO3/c1-3-4-13(17)18-8-12(16)15-11-6-5-10(14)7-9(11)2/h3-7H,8H2,1-2H3,(H,15,16)/b4-3+