N-(4-iodophenyl)-6,7-dimethoxy-quinazolin-4-amine hydrochloride

Systemtic Name: N-(4-iodophenyl)-6,7-dimethoxy-quinazolin-4-amine hydrochloride Openeye Name: N-(4-iodophenyl)-6,7-dimethoxy-quinazolin-4-amine hydrochloride CAS Name: N-(4-iodophenyl)-6,7-dimethoxy-4-quinazolinamine hydrochloride IUPAC Name: N-(4-iodophenyl)-6,7-dimethoxyquinazolin-4-amine hydrochloride Traditional Name: (6,7-dimethoxyquinazolin-4-yl)-(4-iodophenyl)amine hydrochloride Formula: C16H15ClIN3O2 MolecularWeight: 443.66667

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC=C(C=C3)I)OC.Cl

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC=C(C=C3)I)OC.Cl

InChI

InChI=1S/C16H14IN3O2.ClH/c1-21-14-7-12-13(8-15(14)22-2)18-9-19-16(12)20-11-5-3-10(17)4-6-11;/h3-9H,1-2H3,(H,18,19,20);1H