1-[4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-2-phenoxy-propan-1-one hydrochloride

Systemtic Name: 1-[4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-2-phenoxy-propan-1-one hydrochloride Openeye Name: 1-[4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-2-phenoxy-propan-1-one hydrochloride CAS Name: 1-[4-(4-amino-6,7-dimethoxy-2-quinazolinyl)-1-piperazinyl]-2-phenoxy-1-propanone hydrochloride IUPAC Name: 1-[4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-2-phenoxypropan-1-one hydrochloride Traditional Name: 1-[4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazino]-2-phenoxy-propan-1-one hydrochloride Formula: C23H28ClN5O4 MolecularWeight: 473.95252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C2=NC3=CC(=C(C=C3C(=N2)N)OC)OC)OC4=CC=CC=C4.Cl

Isomeric SMILES

CC(C(=O)N1CCN(CC1)C2=NC3=CC(=C(C=C3C(=N2)N)OC)OC)OC4=CC=CC=C4.Cl

InChI

InChI=1S/C23H27N5O4.ClH/c1-15(32-16-7-5-4-6-8-16)22(29)27-9-11-28(12-10-27)23-25-18-14-20(31-3)19(30-2)13-17(18)21(24)26-23;/h4-8,13-15H,9-12H2,1-3H3,(H2,24,25,26);1H