4-(azepan-1-yl)-1-(3-methoxypropyl)-6-methyl-2-oxidanylidene-pyridine-3-carbonitrile

Systemtic Name: 4-(azepan-1-yl)-1-(3-methoxypropyl)-6-methyl-2-oxidanylidene-pyridine-3-carbonitrile Openeye Name: 4-(azepan-1-yl)-1-(3-methoxypropyl)-6-methyl-2-oxo-pyridine-3-carbonitrile CAS Name: 4-(1-azepanyl)-1-(3-methoxypropyl)-6-methyl-2-oxo-3-pyridinecarbonitrile IUPAC Name: 4-(azepan-1-yl)-1-(3-methoxypropyl)-6-methyl-2-oxopyridine-3-carbonitrile Traditional Name: 4-(azepan-1-yl)-2-keto-1-(3-methoxypropyl)-6-methyl-nicotinonitrile Formula: C17H25N3O2 MolecularWeight: 303.3993

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=O)N1CCCOC)C#N)N2CCCCCC2

Isomeric SMILES

CC1=CC(=C(C(=O)N1CCCOC)C#N)N2CCCCCC2

InChI

InChI=1S/C17H25N3O2/c1-14-12-16(19-8-5-3-4-6-9-19)15(13-18)17(21)20(14)10-7-11-22-2/h12H,3-11H2,1-2H3