3-[[4-(phenylmethyl)piperazine-1,4-diium-1-yl]methyl]quinazolin-4-one

Systemtic Name: 3-[[4-(phenylmethyl)piperazine-1,4-diium-1-yl]methyl]quinazolin-4-one Openeye Name: 3-[(4-benzylpiperazine-1,4-diium-1-yl)methyl]quinazolin-4-one CAS Name: 3-[[4-(phenylmethyl)-1-piperazine-1,4-diiumyl]methyl]-4-quinazolinone IUPAC Name: 3-[(4-benzylpiperazine-1,4-diium-1-yl)methyl]quinazolin-4-one Traditional Name: 3-[(4-benzylpiperazine-1,4-diium-1-yl)methyl]quinazolin-4-one Formula: C20H24N4O+2 MolecularWeight: 336.43076

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CC2=CC=CC=C2)CN3C=NC4=CC=CC=C4C3=O

Isomeric SMILES

C1C[NH+](CC[NH+]1CC2=CC=CC=C2)CN3C=NC4=CC=CC=C4C3=O

InChI

InChI=1S/C20H22N4O/c25-20-18-8-4-5-9-19(18)21-15-24(20)16-23-12-10-22(11-13-23)14-17-6-2-1-3-7-17/h1-9,15H,10-14,16H2/p+2