6-oxidanylidene-5-[4-(pyridin-3-ylmethylamino)butyl]cyclohexa-1,3-diene-1-carbonitrile

Systemtic Name: 6-oxidanylidene-5-[4-(pyridin-3-ylmethylamino)butyl]cyclohexa-1,3-diene-1-carbonitrile Openeye Name: 6-oxo-5-[4-(3-pyridylmethylamino)butyl]cyclohexa-1,3-diene-1-carbonitrile CAS Name: 6-oxo-5-[4-(3-pyridinylmethylamino)butyl]-1-cyclohexa-1,3-dienecarbonitrile IUPAC Name: 6-oxo-5-[4-(pyridin-3-ylmethylamino)butyl]cyclohexa-1,3-diene-1-carbonitrile Traditional Name: 6-keto-5-[4-(3-pyridylmethylamino)butyl]cyclohexa-1,3-diene-1-carbonitrile Formula: C17H19N3O MolecularWeight: 281.35226

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(C(=O)C(=C1)C#N)CCCCNCC2=CN=CC=C2

Isomeric SMILES

C1=CC(C(=O)C(=C1)C#N)CCCCNCC2=CN=CC=C2

InChI

InChI=1S/C17H19N3O/c18-11-16-8-3-7-15(17(16)21)6-1-2-9-19-12-14-5-4-10-20-13-14/h3-5,7-8,10,13,15,19H,1-2,6,9,12H2