2-methyl-4-[1-[1-[(2-oxidanylidene-1H-quinolin-3-yl)methyl]piperidin-4-yl]hexyl]benzenecarbonitrile

Systemtic Name: 2-methyl-4-[1-[1-[(2-oxidanylidene-1H-quinolin-3-yl)methyl]piperidin-4-yl]hexyl]benzenecarbonitrile Openeye Name: 2-methyl-4-[1-[1-[(2-oxo-1H-quinolin-3-yl)methyl]-4-piperidyl]hexyl]benzonitrile CAS Name: 2-methyl-4-[1-[1-[(2-oxo-1H-quinolin-3-yl)methyl]-4-piperidinyl]hexyl]benzonitrile IUPAC Name: 2-methyl-4-[1-[1-[(2-oxo-1H-quinolin-3-yl)methyl]piperidin-4-yl]hexyl]benzonitrile Traditional Name: 4-[1-[1-[(2-keto-1H-quinolin-3-yl)methyl]-4-piperidyl]hexyl]-2-methyl-benzonitrile Formula: C29H35N3O MolecularWeight: 441.6077

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C1CCN(CC1)CC2=CC3=CC=CC=C3NC2=O)C4=CC(=C(C=C4)C#N)C

Isomeric SMILES

CCCCCC(C1CCN(CC1)CC2=CC3=CC=CC=C3NC2=O)C4=CC(=C(C=C4)C#N)C

InChI

InChI=1S/C29H35N3O/c1-3-4-5-9-27(23-11-12-25(19-30)21(2)17-23)22-13-15-32(16-14-22)20-26-18-24-8-6-7-10-28(24)31-29(26)33/h6-8,10-12,17-18,22,27H,3-5,9,13-16,20H2,1-2H3,(H,31,33)