N-(4-chloranyl-2-fluoranyl-phenyl)-6-methoxy-7-(3-pyrrolidin-1-ylpropoxy)cinnolin-4-amine hydrochloride

Systemtic Name: N-(4-chloranyl-2-fluoranyl-phenyl)-6-methoxy-7-(3-pyrrolidin-1-ylpropoxy)cinnolin-4-amine hydrochloride Openeye Name: N-(4-chloro-2-fluoro-phenyl)-6-methoxy-7-(3-pyrrolidin-1-ylpropoxy)cinnolin-4-amine hydrochloride CAS Name: N-(4-chloro-2-fluorophenyl)-6-methoxy-7-[3-(1-pyrrolidinyl)propoxy]-4-cinnolinamine hydrochloride IUPAC Name: N-(4-chloro-2-fluorophenyl)-6-methoxy-7-(3-pyrrolidin-1-ylpropoxy)cinnolin-4-amine hydrochloride Traditional Name: (4-chloro-2-fluoro-phenyl)-[6-methoxy-7-(3-pyrrolidinopropoxy)cinnolin-4-yl]amine hydrochloride Formula: C22H25Cl2FN4O2 MolecularWeight: 467.363903

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=CN=N2)NC3=C(C=C(C=C3)Cl)F)OCCCN4CCCC4.Cl

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=CN=N2)NC3=C(C=C(C=C3)Cl)F)OCCCN4CCCC4.Cl

InChI

InChI=1S/C22H24ClFN4O2.ClH/c1-29-21-12-16-19(13-22(21)30-10-4-9-28-7-2-3-8-28)27-25-14-20(16)26-18-6-5-15(23)11-17(18)24;/h5-6,11-14H,2-4,7-10H2,1H3,(H,26,27);1H