2-methylidene-5-oxidanylidene-4-(3-phenoxyphenyl)-1,3,4,6,7,8-hexahydroquinoline-3-carbonitrile

Systemtic Name: 2-methylidene-5-oxidanylidene-4-(3-phenoxyphenyl)-1,3,4,6,7,8-hexahydroquinoline-3-carbonitrile Openeye Name: 2-methylene-5-oxo-4-(3-phenoxyphenyl)-1,3,4,6,7,8-hexahydroquinoline-3-carbonitrile CAS Name: 2-methylene-5-oxo-4-(3-phenoxyphenyl)-1,3,4,6,7,8-hexahydroquinoline-3-carbonitrile IUPAC Name: 2-methylidene-5-oxo-4-(3-phenoxyphenyl)-1,3,4,6,7,8-hexahydroquinoline-3-carbonitrile Traditional Name: 5-keto-2-methylene-4-(3-phenoxyphenyl)-1,3,4,6,7,8-hexahydroquinoline-3-carbonitrile Formula: C23H20N2O2 MolecularWeight: 356.4171

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Descriptors Computed from Structure

Canonical SMILES:

C=C1C(C(C2=C(N1)CCCC2=O)C3=CC(=CC=C3)OC4=CC=CC=C4)C#N

Isomeric SMILES

C=C1C(C(C2=C(N1)CCCC2=O)C3=CC(=CC=C3)OC4=CC=CC=C4)C#N

InChI

InChI=1S/C23H20N2O2/c1-15-19(14-24)22(23-20(25-15)11-6-12-21(23)26)16-7-5-10-18(13-16)27-17-8-3-2-4-9-17/h2-5,7-10,13,19,22,25H,1,6,11-12H2