[2-[2,5-dimethyl-1-[(3-methyl-4-oxidanylidene-phthalazin-1-yl)carbonylamino]pyrrol-3-yl]-2-oxidanylidene-ethyl] ethanoate

Systemtic Name: [2-[2,5-dimethyl-1-[(3-methyl-4-oxidanylidene-phthalazin-1-yl)carbonylamino]pyrrol-3-yl]-2-oxidanylidene-ethyl] ethanoate Openeye Name: [2-[2,5-dimethyl-1-[(3-methyl-4-oxo-phthalazine-1-carbonyl)amino]pyrrol-3-yl]-2-oxo-ethyl] acetate CAS Name: acetic acid [2-[2,5-dimethyl-1-[[(3-methyl-4-oxo-1-phthalazinyl)-oxomethyl]amino]-3-pyrrolyl]-2-oxoethyl] ester IUPAC Name: [2-[2,5-dimethyl-1-[(3-methyl-4-oxophthalazine-1-carbonyl)amino]pyrrol-3-yl]-2-oxoethyl] acetate Traditional Name: acetic acid [2-keto-2-[1-[(4-keto-3-methyl-phthalazine-1-carbonyl)amino]-2,5-dimethyl-pyrrol-3-yl]ethyl] ester Formula: C20H20N4O5 MolecularWeight: 396.3966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C)C)C(=O)COC(=O)C

Isomeric SMILES

CC1=CC(=C(N1NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C)C)C(=O)COC(=O)C

InChI

InChI=1S/C20H20N4O5/c1-11-9-16(17(26)10-29-13(3)25)12(2)24(11)22-19(27)18-14-7-5-6-8-15(14)20(28)23(4)21-18/h5-9H,10H2,1-4H3,(H,22,27)