N-[4-[(2-bromophenyl)methoxy]-3-methoxy-phenyl]-6,7-diethoxy-quinazolin-4-amine hydrochloride

Systemtic Name: N-[4-[(2-bromophenyl)methoxy]-3-methoxy-phenyl]-6,7-diethoxy-quinazolin-4-amine hydrochloride Openeye Name: N-[4-[(2-bromophenyl)methoxy]-3-methoxy-phenyl]-6,7-diethoxy-quinazolin-4-amine hydrochloride CAS Name: N-[4-[(2-bromophenyl)methoxy]-3-methoxyphenyl]-6,7-diethoxy-4-quinazolinamine hydrochloride IUPAC Name: N-[4-[(2-bromophenyl)methoxy]-3-methoxyphenyl]-6,7-diethoxyquinazolin-4-amine hydrochloride Traditional Name: [4-(2-bromobenzyl)oxy-3-methoxy-phenyl]-(6,7-diethoxyquinazolin-4-yl)amine hydrochloride Formula: C26H27BrClN3O4 MolecularWeight: 560.86728

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC(=C(C=C3)OCC4=CC=CC=C4Br)OC)OCC.Cl

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC(=C(C=C3)OCC4=CC=CC=C4Br)OC)OCC.Cl

InChI

InChI=1S/C26H26BrN3O4.ClH/c1-4-32-24-13-19-21(14-25(24)33-5-2)28-16-29-26(19)30-18-10-11-22(23(12-18)31-3)34-15-17-8-6-7-9-20(17)27;/h6-14,16H,4-5,15H2,1-3H3,(H,28,29,30);1H