3-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-6,7-dimethoxy-quinazolin-4-one

Systemtic Name: 3-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-6,7-dimethoxy-quinazolin-4-one Openeye Name: 3-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxo-ethyl]-6,7-dimethoxy-quinazolin-4-one CAS Name: 3-[2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-2-oxoethyl]-6,7-dimethoxy-4-quinazolinone IUPAC Name: 3-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxoethyl]-6,7-dimethoxyquinazolin-4-one Traditional Name: 3-[2-keto-2-(4-piperonylpiperazino)ethyl]-6,7-dimethoxy-quinazolin-4-one Formula: C24H26N4O6 MolecularWeight: 466.48644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)N(C=N2)CC(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)N(C=N2)CC(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5)OC

InChI

InChI=1S/C24H26N4O6/c1-31-20-10-17-18(11-21(20)32-2)25-14-28(24(17)30)13-23(29)27-7-5-26(6-8-27)12-16-3-4-19-22(9-16)34-15-33-19/h3-4,9-11,14H,5-8,12-13,15H2,1-2H3