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

Systemtic Name: 4-[(2-bromophenyl)amino]-3-(furan-2-ylmethylamino)-4-oxidanylidene-butanoic acid Openeye Name: 4-(2-bromoanilino)-3-(2-furylmethylamino)-4-oxo-butanoic acid CAS Name: 4-(2-bromoanilino)-3-(2-furanylmethylamino)-4-oxobutanoic acid IUPAC Name: 4-(2-bromoanilino)-3-(furan-2-ylmethylamino)-4-oxobutanoic acid Traditional Name: 4-(2-bromoanilino)-3-(2-furfurylamino)-4-keto-butyric acid Formula: C15H15BrN2O4 MolecularWeight: 367.1946

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)C(CC(=O)O)NCC2=CC=CO2)Br

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)C(CC(=O)O)NCC2=CC=CO2)Br

InChI

InChI=1S/C15H15BrN2O4/c16-11-5-1-2-6-12(11)18-15(21)13(8-14(19)20)17-9-10-4-3-7-22-10/h1-7,13,17H,8-9H2,(H,18,21)(H,19,20)