6,7-diethoxy-N-(3-iodanylphenyl)quinazolin-4-amine hydrochloride

Systemtic Name: 6,7-diethoxy-N-(3-iodanylphenyl)quinazolin-4-amine hydrochloride Openeye Name: 6,7-diethoxy-N-(3-iodophenyl)quinazolin-4-amine hydrochloride CAS Name: 6,7-diethoxy-N-(3-iodophenyl)-4-quinazolinamine hydrochloride IUPAC Name: 6,7-diethoxy-N-(3-iodophenyl)quinazolin-4-amine hydrochloride Traditional Name: (6,7-diethoxyquinazolin-4-yl)-(3-iodophenyl)amine hydrochloride Formula: C18H19ClIN3O2 MolecularWeight: 471.71983

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC(=CC=C3)I)OCC.Cl

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC(=CC=C3)I)OCC.Cl

InChI

InChI=1S/C18H18IN3O2.ClH/c1-3-23-16-9-14-15(10-17(16)24-4-2)20-11-21-18(14)22-13-7-5-6-12(19)8-13;/h5-11H,3-4H2,1-2H3,(H,20,21,22);1H