[2-[(4,5-dimethyl-1-oxidanylidene-2H-furo[3,4-d]pyridazin-7-yl)amino]-2-oxidanylidene-ethyl] 3-nitrobenzoate

Systemtic Name: [2-[(4,5-dimethyl-1-oxidanylidene-2H-furo[3,4-d]pyridazin-7-yl)amino]-2-oxidanylidene-ethyl] 3-nitrobenzoate Openeye Name: [2-[(4,5-dimethyl-1-oxo-2H-furo[3,4-d]pyridazin-7-yl)amino]-2-oxo-ethyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [2-[(4,5-dimethyl-1-oxo-2H-furo[3,4-d]pyridazin-7-yl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(4,5-dimethyl-1-oxo-2H-furo[3,4-d]pyridazin-7-yl)amino]-2-oxoethyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [2-keto-2-[(1-keto-4,5-dimethyl-2H-furo[3,4-d]pyridazin-7-yl)amino]ethyl] ester Formula: C17H14N4O7 MolecularWeight: 386.31566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=NNC(=O)C2=C(O1)NC(=O)COC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=C2C(=NNC(=O)C2=C(O1)NC(=O)COC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C

InChI

InChI=1S/C17H14N4O7/c1-8-13-9(2)28-16(14(13)15(23)20-19-8)18-12(22)7-27-17(24)10-4-3-5-11(6-10)21(25)26/h3-6H,7H2,1-2H3,(H,18,22)(H,20,23)