1-(cyclooctylmethyl)-4-(2-oxidanylidene-3H-benzimidazol-1-yl)piperidine-4-carbonitrile

Systemtic Name: 1-(cyclooctylmethyl)-4-(2-oxidanylidene-3H-benzimidazol-1-yl)piperidine-4-carbonitrile Openeye Name: 1-(cyclooctylmethyl)-4-(2-oxo-3H-benzimidazol-1-yl)piperidine-4-carbonitrile CAS Name: 1-(cyclooctylmethyl)-4-(2-oxo-3H-benzimidazol-1-yl)-4-piperidinecarbonitrile IUPAC Name: 1-(cyclooctylmethyl)-4-(2-oxo-3H-benzimidazol-1-yl)piperidine-4-carbonitrile Traditional Name: 1-(cyclooctylmethyl)-4-(2-keto-3H-benzimidazol-1-yl)isonipecotonitrile Formula: C22H30N4O MolecularWeight: 366.4998

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)CN2CCC(CC2)(C#N)N3C4=CC=CC=C4NC3=O

Isomeric SMILES

C1CCCC(CCC1)CN2CCC(CC2)(C#N)N3C4=CC=CC=C4NC3=O

InChI

InChI=1S/C22H30N4O/c23-17-22(26-20-11-7-6-10-19(20)24-21(26)27)12-14-25(15-13-22)16-18-8-4-2-1-3-5-9-18/h6-7,10-11,18H,1-5,8-9,12-16H2,(H,24,27)