4-[(4-methyl-2-nitro-phenyl)amino]-2-morpholin-4-yl-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(4-methyl-2-nitro-phenyl)amino]-2-morpholin-4-yl-4-oxidanylidene-butanoic acid Openeye Name: 4-(4-methyl-2-nitro-anilino)-2-morpholino-4-oxo-butanoic acid CAS Name: 4-(4-methyl-2-nitroanilino)-2-(4-morpholinyl)-4-oxobutanoic acid IUPAC Name: 4-(4-methyl-2-nitroanilino)-2-morpholin-4-yl-4-oxobutanoic acid Traditional Name: 4-keto-4-(4-methyl-2-nitro-anilino)-2-morpholino-butyric acid Formula: C15H19N3O6 MolecularWeight: 337.32786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CC(C(=O)O)N2CCOCC2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CC(C(=O)O)N2CCOCC2)[N+](=O)[O-]

InChI

InChI=1S/C15H19N3O6/c1-10-2-3-11(12(8-10)18(22)23)16-14(19)9-13(15(20)21)17-4-6-24-7-5-17/h2-3,8,13H,4-7,9H2,1H3,(H,16,19)(H,20,21)