N-[3-chloranyl-4-(furan-3-ylmethoxy)phenyl]-6,7-dimethoxy-quinazolin-2-amine hydrochloride

Systemtic Name: N-[3-chloranyl-4-(furan-3-ylmethoxy)phenyl]-6,7-dimethoxy-quinazolin-2-amine hydrochloride Openeye Name: N-[3-chloro-4-(3-furylmethoxy)phenyl]-6,7-dimethoxy-quinazolin-2-amine hydrochloride CAS Name: N-[3-chloro-4-(3-furanylmethoxy)phenyl]-6,7-dimethoxy-2-quinazolinamine hydrochloride IUPAC Name: N-[3-chloro-4-(furan-3-ylmethoxy)phenyl]-6,7-dimethoxyquinazolin-2-amine hydrochloride Traditional Name: [3-chloro-4-(3-furfuryloxy)phenyl]-(6,7-dimethoxyquinazolin-2-yl)amine hydrochloride Formula: C21H19Cl2N3O4 MolecularWeight: 448.29926

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18ClN3O4.ClH/c1-26-19-7-14-10-23-21(25-17(14)9-20(19)27-2)24-15-3-4-18(16(22)8-15)29-12-13-5-6-28-11-13;/h3-11H,12H2,1-2H3,(H,23,24,25);1H