2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-4,7,7-trimethyl-6,8-dihydroquinazolin-5-one

Systemtic Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-4,7,7-trimethyl-6,8-dihydroquinazolin-5-one Openeye Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-4,7,7-trimethyl-6,8-dihydroquinazolin-5-one CAS Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-4,7,7-trimethyl-6,8-dihydroquinazolin-5-one IUPAC Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-4,7,7-trimethyl-6,8-dihydroquinazolin-5-one Traditional Name: 4,7,7-trimethyl-2-(4-piperonylpiperazino)-6,8-dihydroquinazolin-5-one Formula: C23H28N4O3 MolecularWeight: 408.49342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC2=C1C(=O)CC(C2)(C)C)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=NC(=NC2=C1C(=O)CC(C2)(C)C)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H28N4O3/c1-15-21-17(11-23(2,3)12-18(21)28)25-22(24-15)27-8-6-26(7-9-27)13-16-4-5-19-20(10-16)30-14-29-19/h4-5,10H,6-9,11-14H2,1-3H3