4-[(3-bromophenyl)methylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(3-bromophenyl)methylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[(3-bromophenyl)methylamino]-4-oxo-butanoic acid CAS Name: 4-[(3-bromophenyl)methylamino]-4-oxobutanoic acid IUPAC Name: 4-[(3-bromophenyl)methylamino]-4-oxobutanoic acid Traditional Name: 4-[(3-bromobenzyl)amino]-4-keto-butyric acid Formula: C11H12BrNO3 MolecularWeight: 286.12188

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)CNC(=O)CCC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)Br)CNC(=O)CCC(=O)O

InChI

InChI=1S/C11H12BrNO3/c12-9-3-1-2-8(6-9)7-13-10(14)4-5-11(15)16/h1-3,6H,4-5,7H2,(H,13,14)(H,15,16)