2-azanyl-4-(2,5-diethoxyphenyl)-1-(2-fluorophenyl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-azanyl-4-(2,5-diethoxyphenyl)-1-(2-fluorophenyl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-4-(2,5-diethoxyphenyl)-1-(2-fluorophenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-4-(2,5-diethoxyphenyl)-1-(2-fluorophenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-4-(2,5-diethoxyphenyl)-1-(2-fluorophenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-4-(2,5-diethoxyphenyl)-1-(2-fluorophenyl)-5-keto-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C26H26FN3O3 MolecularWeight: 447.501343

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)OCC)C2C(=C(N(C3=C2C(=O)CCC3)C4=CC=CC=C4F)N)C#N

Isomeric SMILES

CCOC1=CC(=C(C=C1)OCC)C2C(=C(N(C3=C2C(=O)CCC3)C4=CC=CC=C4F)N)C#N

InChI

InChI=1S/C26H26FN3O3/c1-3-32-16-12-13-23(33-4-2)17(14-16)24-18(15-28)26(29)30(20-9-6-5-8-19(20)27)21-10-7-11-22(31)25(21)24/h5-6,8-9,12-14,24H,3-4,7,10-11,29H2,1-2H3