methyl 2-(bromomethyl)-4-oxidanylidene-4-phenylazanyl-butanoate

Systemtic Name: methyl 2-(bromomethyl)-4-oxidanylidene-4-phenylazanyl-butanoate Openeye Name: methyl 4-anilino-2-(bromomethyl)-4-oxo-butanoate CAS Name: 4-anilino-2-(bromomethyl)-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-anilino-2-(bromomethyl)-4-oxobutanoate Traditional Name: 4-anilino-2-(bromomethyl)-4-keto-butyric acid methyl ester Formula: C12H14BrNO3 MolecularWeight: 300.14846

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC(=O)NC1=CC=CC=C1)CBr

Isomeric SMILES

COC(=O)C(CC(=O)NC1=CC=CC=C1)CBr

InChI

InChI=1S/C12H14BrNO3/c1-17-12(16)9(8-13)7-11(15)14-10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3,(H,14,15)