N-(1,3-benzodioxol-4-yl)-6,7-bis(2-methoxyethoxy)quinazolin-4-amine hydrochloride

Systemtic Name: N-(1,3-benzodioxol-4-yl)-6,7-bis(2-methoxyethoxy)quinazolin-4-amine hydrochloride Openeye Name: N-(1,3-benzodioxol-4-yl)-6,7-bis(2-methoxyethoxy)quinazolin-4-amine hydrochloride CAS Name: N-(1,3-benzodioxol-4-yl)-6,7-bis(2-methoxyethoxy)-4-quinazolinamine hydrochloride IUPAC Name: N-(1,3-benzodioxol-4-yl)-6,7-bis(2-methoxyethoxy)quinazolin-4-amine hydrochloride Traditional Name: 1,3-benzodioxol-4-yl-[6,7-bis(2-methoxyethoxy)quinazolin-4-yl]amine hydrochloride Formula: C21H24ClN3O6 MolecularWeight: 449.88476

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(C=C2C(=C1)C(=NC=N2)NC3=C4C(=CC=C3)OCO4)OCCOC.Cl

Isomeric SMILES

COCCOC1=C(C=C2C(=C1)C(=NC=N2)NC3=C4C(=CC=C3)OCO4)OCCOC.Cl

InChI

InChI=1S/C21H23N3O6.ClH/c1-25-6-8-27-18-10-14-16(11-19(18)28-9-7-26-2)22-12-23-21(14)24-15-4-3-5-17-20(15)30-13-29-17;/h3-5,10-12H,6-9,13H2,1-2H3,(H,22,23,24);1H