3-(3,4-dimethoxyphenyl)-N-[2-[3-(4-methylpiperidin-1-yl)propylamino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-(3,4-dimethoxyphenyl)-N-[2-[3-(4-methylpiperidin-1-yl)propylamino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-(3,4-dimethoxyphenyl)-N-[2-[3-(4-methyl-1-piperidyl)propylamino]-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-(3,4-dimethoxyphenyl)-N-[2-[3-(4-methyl-1-piperidinyl)propylamino]-2-oxoethyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-(3,4-dimethoxyphenyl)-N-[2-[3-(4-methylpiperidin-1-yl)propylamino]-2-oxoethyl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-(3,4-dimethoxyphenyl)-4-keto-N-[2-keto-2-[3-(4-methylpiperidino)propylamino]ethyl]phthalazine-1-carboxamide Formula: C28H35N5O5 MolecularWeight: 521.608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)CCCNC(=O)CNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC1CCN(CC1)CCCNC(=O)CNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C28H35N5O5/c1-19-11-15-32(16-12-19)14-6-13-29-25(34)18-30-27(35)26-21-7-4-5-8-22(21)28(36)33(31-26)20-9-10-23(37-2)24(17-20)38-3/h4-5,7-10,17,19H,6,11-16,18H2,1-3H3,(H,29,34)(H,30,35)