4-[(3,4-dimethoxyphenyl)amino]-6-fluoranyl-quinoline-3-carbonitrile hydrochloride

Systemtic Name: 4-[(3,4-dimethoxyphenyl)amino]-6-fluoranyl-quinoline-3-carbonitrile hydrochloride Openeye Name: 4-(3,4-dimethoxyanilino)-6-fluoro-quinoline-3-carbonitrile hydrochloride CAS Name: 4-(3,4-dimethoxyanilino)-6-fluoro-3-quinolinecarbonitrile hydrochloride IUPAC Name: 4-(3,4-dimethoxyanilino)-6-fluoroquinoline-3-carbonitrile hydrochloride Traditional Name: 4-(3,4-dimethoxyanilino)-6-fluoro-quinoline-3-carbonitrile hydrochloride Formula: C18H15ClFN3O2 MolecularWeight: 359.782003

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2=C3C=C(C=CC3=NC=C2C#N)F)OC.Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC2=C3C=C(C=CC3=NC=C2C#N)F)OC.Cl

InChI

InChI=1S/C18H14FN3O2.ClH/c1-23-16-6-4-13(8-17(16)24-2)22-18-11(9-20)10-21-15-5-3-12(19)7-14(15)18;/h3-8,10H,1-2H3,(H,21,22);1H