6-(aziridin-1-yl)-4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-7-methoxy-quinoline-3-carbonitrile

Systemtic Name: 6-(aziridin-1-yl)-4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-7-methoxy-quinoline-3-carbonitrile Openeye Name: 6-(aziridin-1-yl)-4-(3-chloro-4-fluoro-anilino)-7-methoxy-quinoline-3-carbonitrile CAS Name: 6-(1-aziridinyl)-4-(3-chloro-4-fluoroanilino)-7-methoxy-3-quinolinecarbonitrile IUPAC Name: 6-(aziridin-1-yl)-4-(3-chloro-4-fluoroanilino)-7-methoxyquinoline-3-carbonitrile Traditional Name: 4-(3-chloro-4-fluoro-anilino)-6-ethylenimino-7-methoxy-quinoline-3-carbonitrile Formula: C19H14ClFN4O MolecularWeight: 368.792063

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N=CC(=C2NC3=CC(=C(C=C3)F)Cl)C#N)N4CC4

Isomeric SMILES

COC1=C(C=C2C(=C1)N=CC(=C2NC3=CC(=C(C=C3)F)Cl)C#N)N4CC4

InChI

InChI=1S/C19H14ClFN4O/c1-26-18-8-16-13(7-17(18)25-4-5-25)19(11(9-22)10-23-16)24-12-2-3-15(21)14(20)6-12/h2-3,6-8,10H,4-5H2,1H3,(H,23,24)