N-[3,4-bis(phenylmethoxy)phenyl]-6,7-dimethoxy-quinazolin-4-amine hydrochloride

Systemtic Name: N-[3,4-bis(phenylmethoxy)phenyl]-6,7-dimethoxy-quinazolin-4-amine hydrochloride Openeye Name: N-(3,4-dibenzyloxyphenyl)-6,7-dimethoxy-quinazolin-4-amine hydrochloride CAS Name: N-[3,4-bis(phenylmethoxy)phenyl]-6,7-dimethoxy-4-quinazolinamine hydrochloride IUPAC Name: N-[3,4-bis(phenylmethoxy)phenyl]-6,7-dimethoxyquinazolin-4-amine hydrochloride Traditional Name: (3,4-dibenzoxyphenyl)-(6,7-dimethoxyquinazolin-4-yl)amine hydrochloride Formula: C30H28ClN3O4 MolecularWeight: 530.01402

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)OCC4=CC=CC=C4)OCC5=CC=CC=C5)OC.Cl

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC(=C(C=C3)OCC4=CC=CC=C4)OCC5=CC=CC=C5)OC.Cl

InChI

InChI=1S/C30H27N3O4.ClH/c1-34-27-16-24-25(17-28(27)35-2)31-20-32-30(24)33-23-13-14-26(36-18-21-9-5-3-6-10-21)29(15-23)37-19-22-11-7-4-8-12-22;/h3-17,20H,18-19H2,1-2H3,(H,31,32,33);1H