7-methoxy-4-piperazin-4-ium-1-yl-quinazoline

Systemtic Name: 7-methoxy-4-piperazin-4-ium-1-yl-quinazoline Openeye Name: 7-methoxy-4-piperazin-4-ium-1-yl-quinazoline CAS Name: 7-methoxy-4-(1-piperazin-4-iumyl)quinazoline IUPAC Name: 7-methoxy-4-piperazin-4-ium-1-ylquinazoline Traditional Name: 7-methoxy-4-piperazin-4-ium-1-yl-quinazoline Formula: C13H17N4O+ MolecularWeight: 245.30028

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=NC=N2)N3CC[NH2+]CC3

Isomeric SMILES

COC1=CC2=C(C=C1)C(=NC=N2)N3CC[NH2+]CC3

InChI

InChI=1S/C13H16N4O/c1-18-10-2-3-11-12(8-10)15-9-16-13(11)17-6-4-14-5-7-17/h2-3,8-9,14H,4-7H2,1H3/p+1