[2-[(4-bromanyl-3-methyl-phenyl)amino]-2-oxidanylidene-ethyl] butanoate

Systemtic Name: [2-[(4-bromanyl-3-methyl-phenyl)amino]-2-oxidanylidene-ethyl] butanoate Openeye Name: [2-(4-bromo-3-methyl-anilino)-2-oxo-ethyl] butanoate CAS Name: butanoic acid [2-(4-bromo-3-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-bromo-3-methylanilino)-2-oxoethyl] butanoate Traditional Name: butyric acid [2-(4-bromo-3-methyl-anilino)-2-keto-ethyl] ester Formula: C13H16BrNO3 MolecularWeight: 314.17504

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16BrNO3/c1-3-4-13(17)18-8-12(16)15-10-5-6-11(14)9(2)7-10/h5-7H,3-4,8H2,1-2H3,(H,15,16)