1-(3-oxidanyltetradecanoyl)-4-phenyl-piperidine-4-carbonitrile

Systemtic Name: 1-(3-oxidanyltetradecanoyl)-4-phenyl-piperidine-4-carbonitrile Openeye Name: 1-(3-hydroxytetradecanoyl)-4-phenyl-piperidine-4-carbonitrile CAS Name: 1-(3-hydroxy-1-oxotetradecyl)-4-phenyl-4-piperidinecarbonitrile IUPAC Name: 1-(3-hydroxytetradecanoyl)-4-phenylpiperidine-4-carbonitrile Traditional Name: 1-(3-hydroxytetradecanoyl)-4-phenyl-isonipecotonitrile Formula: C26H40N2O2 MolecularWeight: 412.608

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(CC(=O)N1CCC(CC1)(C#N)C2=CC=CC=C2)O

Isomeric SMILES

CCCCCCCCCCCC(CC(=O)N1CCC(CC1)(C#N)C2=CC=CC=C2)O

InChI

InChI=1S/C26H40N2O2/c1-2-3-4-5-6-7-8-9-13-16-24(29)21-25(30)28-19-17-26(22-27,18-20-28)23-14-11-10-12-15-23/h10-12,14-15,24,29H,2-9,13,16-21H2,1H3