2,6-bis(azanyl)-1-(3-chloranyl-4-fluoranyl-phenyl)-7-ethoxy-4H-quinoline-3-carbonitrile

Systemtic Name: 2,6-bis(azanyl)-1-(3-chloranyl-4-fluoranyl-phenyl)-7-ethoxy-4H-quinoline-3-carbonitrile Openeye Name: 2,6-diamino-1-(3-chloro-4-fluoro-phenyl)-7-ethoxy-4H-quinoline-3-carbonitrile CAS Name: 2,6-diamino-1-(3-chloro-4-fluorophenyl)-7-ethoxy-4H-quinoline-3-carbonitrile IUPAC Name: 2,6-diamino-1-(3-chloro-4-fluorophenyl)-7-ethoxy-4H-quinoline-3-carbonitrile Traditional Name: 2,6-diamino-1-(3-chloro-4-fluoro-phenyl)-7-ethoxy-4H-quinoline-3-carbonitrile Formula: C18H16ClFN4O MolecularWeight: 358.797243

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2CC(=C(N(C2=C1)C3=CC(=C(C=C3)F)Cl)N)C#N)N

Isomeric SMILES

CCOC1=C(C=C2CC(=C(N(C2=C1)C3=CC(=C(C=C3)F)Cl)N)C#N)N

InChI

InChI=1S/C18H16ClFN4O/c1-2-25-17-8-16-10(6-15(17)22)5-11(9-21)18(23)24(16)12-3-4-14(20)13(19)7-12/h3-4,6-8H,2,5,22-23H2,1H3