2-[4-(phenylmethyl)piperazin-4-ium-1-yl]-5,6,7,8-tetrahydro-1H-quinazolin-4-one

Systemtic Name: 2-[4-(phenylmethyl)piperazin-4-ium-1-yl]-5,6,7,8-tetrahydro-1H-quinazolin-4-one Openeye Name: 2-(4-benzylpiperazin-4-ium-1-yl)-5,6,7,8-tetrahydro-1H-quinazolin-4-one CAS Name: 2-[4-(phenylmethyl)-1-piperazin-4-iumyl]-5,6,7,8-tetrahydro-1H-quinazolin-4-one IUPAC Name: 2-(4-benzylpiperazin-4-ium-1-yl)-5,6,7,8-tetrahydro-1H-quinazolin-4-one Traditional Name: 2-(4-benzylpiperazin-4-ium-1-yl)-5,6,7,8-tetrahydro-1H-quinazolin-4-one Formula: C19H25N4O+ MolecularWeight: 325.428

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=O)N=C(N2)N3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

C1CCC2=C(C1)C(=O)N=C(N2)N3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C19H24N4O/c24-18-16-8-4-5-9-17(16)20-19(21-18)23-12-10-22(11-13-23)14-15-6-2-1-3-7-15/h1-3,6-7H,4-5,8-14H2,(H,20,21,24)/p+1