6-methoxy-4-[4-(phenylmethyl)piperazin-4-ium-1-yl]quinazoline

Systemtic Name: 6-methoxy-4-[4-(phenylmethyl)piperazin-4-ium-1-yl]quinazoline Openeye Name: 4-(4-benzylpiperazin-4-ium-1-yl)-6-methoxy-quinazoline CAS Name: 6-methoxy-4-[4-(phenylmethyl)-1-piperazin-4-iumyl]quinazoline IUPAC Name: 4-(4-benzylpiperazin-4-ium-1-yl)-6-methoxyquinazoline Traditional Name: 4-(4-benzylpiperazin-4-ium-1-yl)-6-methoxy-quinazoline Formula: C20H23N4O+ MolecularWeight: 335.42282

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=CN=C2N3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)N=CN=C2N3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C20H22N4O/c1-25-17-7-8-19-18(13-17)20(22-15-21-19)24-11-9-23(10-12-24)14-16-5-3-2-4-6-16/h2-8,13,15H,9-12,14H2,1H3/p+1