7,7-dimethyl-2-[4-(phenylmethyl)piperazin-4-ium-1-yl]-6,8-dihydroquinazolin-5-one

Systemtic Name: 7,7-dimethyl-2-[4-(phenylmethyl)piperazin-4-ium-1-yl]-6,8-dihydroquinazolin-5-one Openeye Name: 2-(4-benzylpiperazin-4-ium-1-yl)-7,7-dimethyl-6,8-dihydroquinazolin-5-one CAS Name: 7,7-dimethyl-2-[4-(phenylmethyl)-1-piperazin-4-iumyl]-6,8-dihydroquinazolin-5-one IUPAC Name: 2-(4-benzylpiperazin-4-ium-1-yl)-7,7-dimethyl-6,8-dihydroquinazolin-5-one Traditional Name: 2-(4-benzylpiperazin-4-ium-1-yl)-7,7-dimethyl-6,8-dihydroquinazolin-5-one Formula: C21H27N4O+ MolecularWeight: 351.46528

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=NC(=NC=C2C(=O)C1)N3CC[NH+](CC3)CC4=CC=CC=C4)C

Isomeric SMILES

CC1(CC2=NC(=NC=C2C(=O)C1)N3CC[NH+](CC3)CC4=CC=CC=C4)C

InChI

InChI=1S/C21H26N4O/c1-21(2)12-18-17(19(26)13-21)14-22-20(23-18)25-10-8-24(9-11-25)15-16-6-4-3-5-7-16/h3-7,14H,8-13,15H2,1-2H3/p+1