3-[2-[4-(1H-indol-3-yl)piperidin-1-yl]-2-oxidanylidene-ethyl]-2H-phthalazine-1,4-dione

Systemtic Name: 3-[2-[4-(1H-indol-3-yl)piperidin-1-yl]-2-oxidanylidene-ethyl]-2H-phthalazine-1,4-dione Openeye Name: 3-[2-[4-(1H-indol-3-yl)-1-piperidyl]-2-oxo-ethyl]-2H-phthalazine-1,4-dione CAS Name: 3-[2-[4-(1H-indol-3-yl)-1-piperidinyl]-2-oxoethyl]-2H-phthalazine-1,4-dione IUPAC Name: 3-[2-[4-(1H-indol-3-yl)piperidin-1-yl]-2-oxoethyl]-2H-phthalazine-1,4-dione Traditional Name: 3-[2-[4-(1H-indol-3-yl)piperidino]-2-keto-ethyl]-2H-phthalazine-1,4-quinone Formula: C23H22N4O3 MolecularWeight: 402.44578

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=CNC3=CC=CC=C32)C(=O)CN4C(=O)C5=CC=CC=C5C(=O)N4

Isomeric SMILES

C1CN(CCC1C2=CNC3=CC=CC=C32)C(=O)CN4C(=O)C5=CC=CC=C5C(=O)N4

InChI

InChI=1S/C23H22N4O3/c28-21(14-27-23(30)18-7-2-1-6-17(18)22(29)25-27)26-11-9-15(10-12-26)19-13-24-20-8-4-3-5-16(19)20/h1-8,13,15,24H,9-12,14H2,(H,25,29)