2-[4-[3-[(6-methoxyquinazolin-4-yl)amino]propyl]piperazin-4-ium-1-yl]ethanol

Systemtic Name: 2-[4-[3-[(6-methoxyquinazolin-4-yl)amino]propyl]piperazin-4-ium-1-yl]ethanol Openeye Name: 2-[4-[3-[(6-methoxyquinazolin-4-yl)amino]propyl]piperazin-4-ium-1-yl]ethanol CAS Name: 2-[4-[3-[(6-methoxy-4-quinazolinyl)amino]propyl]-1-piperazin-4-iumyl]ethanol IUPAC Name: 2-[4-[3-[(6-methoxyquinazolin-4-yl)amino]propyl]piperazin-4-ium-1-yl]ethanol Traditional Name: 2-[4-[3-[(6-methoxyquinazolin-4-yl)amino]propyl]piperazin-4-ium-1-yl]ethanol Formula: C18H28N5O2+ MolecularWeight: 346.44722

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=CN=C2NCCC[NH+]3CCN(CC3)CCO

Isomeric SMILES

COC1=CC2=C(C=C1)N=CN=C2NCCC[NH+]3CCN(CC3)CCO

InChI

InChI=1S/C18H27N5O2/c1-25-15-3-4-17-16(13-15)18(21-14-20-17)19-5-2-6-22-7-9-23(10-8-22)11-12-24/h3-4,13-14,24H,2,5-12H2,1H3,(H,19,20,21)/p+1