methyl 4-[2-(methoxycarbonylamino)-2-oxidanylidene-ethyl]-2-methyl-6-nitro-1,3-bis(oxidanylidene)isoquinoline-4-carboxylate

Systemtic Name: methyl 4-[2-(methoxycarbonylamino)-2-oxidanylidene-ethyl]-2-methyl-6-nitro-1,3-bis(oxidanylidene)isoquinoline-4-carboxylate Openeye Name: methyl 4-[2-(methoxycarbonylamino)-2-oxo-ethyl]-2-methyl-6-nitro-1,3-dioxo-isoquinoline-4-carboxylate CAS Name: 4-[2-(methoxycarbonylamino)-2-oxoethyl]-2-methyl-6-nitro-1,3-dioxo-4-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 4-[2-(methoxycarbonylamino)-2-oxoethyl]-2-methyl-6-nitro-1,3-dioxoisoquinoline-4-carboxylate Traditional Name: 4-[2-(carbomethoxyamino)-2-keto-ethyl]-1,3-diketo-2-methyl-6-nitro-isoquinoline-4-carboxylic acid methyl ester Formula: C16H15N3O9 MolecularWeight: 393.305

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C=C(C=C2)[N+](=O)[O-])C(C1=O)(CC(=O)NC(=O)OC)C(=O)OC

Isomeric SMILES

CN1C(=O)C2=C(C=C(C=C2)[N+](=O)[O-])C(C1=O)(CC(=O)NC(=O)OC)C(=O)OC

InChI

InChI=1S/C16H15N3O9/c1-18-12(21)9-5-4-8(19(25)26)6-10(9)16(13(18)22,14(23)27-2)7-11(20)17-15(24)28-3/h4-6H,7H2,1-3H3,(H,17,20,24)