4-[[(6,7,8-trimethoxyquinazolin-4-yl)amino]methyl]benzene-1,2-diol hydrochloride

Systemtic Name: 4-[[(6,7,8-trimethoxyquinazolin-4-yl)amino]methyl]benzene-1,2-diol hydrochloride Openeye Name: 4-[[(6,7,8-trimethoxyquinazolin-4-yl)amino]methyl]benzene-1,2-diol hydrochloride CAS Name: 4-[[(6,7,8-trimethoxy-4-quinazolinyl)amino]methyl]benzene-1,2-diol hydrochloride IUPAC Name: 4-[[(6,7,8-trimethoxyquinazolin-4-yl)amino]methyl]benzene-1,2-diol hydrochloride Traditional Name: 4-[[(6,7,8-trimethoxyquinazolin-4-yl)amino]methyl]pyrocatechol hydrochloride Formula: C18H20ClN3O5 MolecularWeight: 393.8215

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C2C(=C1)C(=NC=N2)NCC3=CC(=C(C=C3)O)O)OC)OC.Cl

Isomeric SMILES

COC1=C(C(=C2C(=C1)C(=NC=N2)NCC3=CC(=C(C=C3)O)O)OC)OC.Cl

InChI

InChI=1S/C18H19N3O5.ClH/c1-24-14-7-11-15(17(26-3)16(14)25-2)20-9-21-18(11)19-8-10-4-5-12(22)13(23)6-10;/h4-7,9,22-23H,8H2,1-3H3,(H,19,20,21);1H