2-[4-(2-chloranyl-6,7-dimethoxy-quinazolin-4-yl)piperazin-1-ium-1-yl]ethanol

Systemtic Name: 2-[4-(2-chloranyl-6,7-dimethoxy-quinazolin-4-yl)piperazin-1-ium-1-yl]ethanol Openeye Name: 2-[4-(2-chloro-6,7-dimethoxy-quinazolin-4-yl)piperazin-1-ium-1-yl]ethanol CAS Name: 2-[4-(2-chloro-6,7-dimethoxy-4-quinazolinyl)-1-piperazin-1-iumyl]ethanol IUPAC Name: 2-[4-(2-chloro-6,7-dimethoxyquinazolin-4-yl)piperazin-1-ium-1-yl]ethanol Traditional Name: 2-[4-(2-chloro-6,7-dimethoxy-quinazolin-4-yl)piperazin-1-ium-1-yl]ethanol Formula: C16H22ClN4O3+ MolecularWeight: 353.82388

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)Cl)N3CC[NH+](CC3)CCO)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)Cl)N3CC[NH+](CC3)CCO)OC

InChI

InChI=1S/C16H21ClN4O3/c1-23-13-9-11-12(10-14(13)24-2)18-16(17)19-15(11)21-5-3-20(4-6-21)7-8-22/h9-10,22H,3-8H2,1-2H3/p+1