4-[(4-bromophenyl)amino]-3-(2-hydroxyethylamino)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(4-bromophenyl)amino]-3-(2-hydroxyethylamino)-4-oxidanylidene-butanoic acid Openeye Name: 4-(4-bromoanilino)-3-(2-hydroxyethylamino)-4-oxo-butanoic acid CAS Name: 4-(4-bromoanilino)-3-(2-hydroxyethylamino)-4-oxobutanoic acid IUPAC Name: 4-(4-bromoanilino)-3-(2-hydroxyethylamino)-4-oxobutanoic acid Traditional Name: 4-(4-bromoanilino)-3-(2-hydroxyethylamino)-4-keto-butyric acid Formula: C12H15BrN2O4 MolecularWeight: 331.1625

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)C(CC(=O)O)NCCO)Br

Isomeric SMILES

C1=CC(=CC=C1NC(=O)C(CC(=O)O)NCCO)Br

InChI

InChI=1S/C12H15BrN2O4/c13-8-1-3-9(4-2-8)15-12(19)10(7-11(17)18)14-5-6-16/h1-4,10,14,16H,5-7H2,(H,15,19)(H,17,18)