4-[(3-chloranyl-4-methoxy-phenyl)amino]quinoline-3-carbonitrile hydrochloride

Systemtic Name: 4-[(3-chloranyl-4-methoxy-phenyl)amino]quinoline-3-carbonitrile hydrochloride Openeye Name: 4-(3-chloro-4-methoxy-anilino)quinoline-3-carbonitrile hydrochloride CAS Name: 4-(3-chloro-4-methoxyanilino)-3-quinolinecarbonitrile hydrochloride IUPAC Name: 4-(3-chloro-4-methoxyanilino)quinoline-3-carbonitrile hydrochloride Traditional Name: 4-(3-chloro-4-methoxy-anilino)quinoline-3-carbonitrile hydrochloride Formula: C17H13Cl2N3O MolecularWeight: 346.21062

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2=C(C=NC3=CC=CC=C32)C#N)Cl.Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC2=C(C=NC3=CC=CC=C32)C#N)Cl.Cl

InChI

InChI=1S/C17H12ClN3O.ClH/c1-22-16-7-6-12(8-14(16)18)21-17-11(9-19)10-20-15-5-3-2-4-13(15)17;/h2-8,10H,1H3,(H,20,21);1H