2-[4-[3-[(6,7-dimethoxyquinazolin-4-yl)amino]propyl]piperazin-4-ium-1-yl]ethanol

Systemtic Name: 2-[4-[3-[(6,7-dimethoxyquinazolin-4-yl)amino]propyl]piperazin-4-ium-1-yl]ethanol Openeye Name: 2-[4-[3-[(6,7-dimethoxyquinazolin-4-yl)amino]propyl]piperazin-4-ium-1-yl]ethanol CAS Name: 2-[4-[3-[(6,7-dimethoxy-4-quinazolinyl)amino]propyl]-1-piperazin-4-iumyl]ethanol IUPAC Name: 2-[4-[3-[(6,7-dimethoxyquinazolin-4-yl)amino]propyl]piperazin-4-ium-1-yl]ethanol Traditional Name: 2-[4-[3-[(6,7-dimethoxyquinazolin-4-yl)amino]propyl]piperazin-4-ium-1-yl]ethanol Formula: C19H30N5O3+ MolecularWeight: 376.4732

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)NCCC[NH+]3CCN(CC3)CCO)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)NCCC[NH+]3CCN(CC3)CCO)OC

InChI

InChI=1S/C19H29N5O3/c1-26-17-12-15-16(13-18(17)27-2)21-14-22-19(15)20-4-3-5-23-6-8-24(9-7-23)10-11-25/h12-14,25H,3-11H2,1-2H3,(H,20,21,22)/p+1