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

Systemtic Name: 4-[(3-chlorophenyl)amino]-2-(furan-2-ylmethylamino)-4-oxidanylidene-butanoic acid Openeye Name: 4-(3-chloroanilino)-2-(2-furylmethylamino)-4-oxo-butanoic acid CAS Name: 4-(3-chloroanilino)-2-(2-furanylmethylamino)-4-oxobutanoic acid IUPAC Name: 4-(3-chloroanilino)-2-(furan-2-ylmethylamino)-4-oxobutanoic acid Traditional Name: 4-(3-chloroanilino)-2-(2-furfurylamino)-4-keto-butyric acid Formula: C15H15ClN2O4 MolecularWeight: 322.7436

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H15ClN2O4/c16-10-3-1-4-11(7-10)18-14(19)8-13(15(20)21)17-9-12-5-2-6-22-12/h1-7,13,17H,8-9H2,(H,18,19)(H,20,21)