2-methoxycarbonyl-3-(2-methoxy-2-oxidanylidene-ethyl)-2,10b-dihydro-1H-pyrrolo[2,1-a]phthalazine-1,3-dicarboxylic acid

Systemtic Name: 2-methoxycarbonyl-3-(2-methoxy-2-oxidanylidene-ethyl)-2,10b-dihydro-1H-pyrrolo[2,1-a]phthalazine-1,3-dicarboxylic acid Openeye Name: 2-methoxycarbonyl-3-(2-methoxy-2-oxo-ethyl)-2,10b-dihydro-1H-pyrrolo[2,1-a]phthalazine-1,3-dicarboxylic acid CAS Name: 2-methoxycarbonyl-3-(2-methoxy-2-oxoethyl)-2,10b-dihydro-1H-pyrrolo[2,1-a]phthalazine-1,3-dicarboxylic acid IUPAC Name: 2-methoxycarbonyl-3-(2-methoxy-2-oxoethyl)-2,10b-dihydro-1H-pyrrolo[2,1-a]phthalazine-1,3-dicarboxylic acid Traditional Name: 2-carbomethoxy-3-(2-keto-2-methoxy-ethyl)-2,10b-dihydro-1H-pyrrolo[2,1-a]phthalazine-1,3-dicarboxylic acid Formula: C18H18N2O8 MolecularWeight: 390.34412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1(C(C(C2N1N=CC3=CC=CC=C23)C(=O)O)C(=O)OC)C(=O)O

Isomeric SMILES

COC(=O)CC1(C(C(C2N1N=CC3=CC=CC=C23)C(=O)O)C(=O)OC)C(=O)O

InChI

InChI=1S/C18H18N2O8/c1-27-11(21)7-18(17(25)26)13(16(24)28-2)12(15(22)23)14-10-6-4-3-5-9(10)8-19-20(14)18/h3-6,8,12-14H,7H2,1-2H3,(H,22,23)(H,25,26)