6,7-dimethoxy-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]quinazolin-4-amine

Systemtic Name: 6,7-dimethoxy-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]quinazolin-4-amine Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-6,7-dimethoxy-quinazolin-4-amine CAS Name: 6,7-dimethoxy-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]-4-quinazolinamine IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-6,7-dimethoxyquinazolin-4-amine Traditional Name: (1-benzylpiperidin-1-ium-4-yl)-(6,7-dimethoxyquinazolin-4-yl)amine Formula: C22H27N4O2+ MolecularWeight: 379.47538

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)NC3CC[NH+](CC3)CC4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)NC3CC[NH+](CC3)CC4=CC=CC=C4)OC

InChI

InChI=1S/C22H26N4O2/c1-27-20-12-18-19(13-21(20)28-2)23-15-24-22(18)25-17-8-10-26(11-9-17)14-16-6-4-3-5-7-16/h3-7,12-13,15,17H,8-11,14H2,1-2H3,(H,23,24,25)/p+1