N-[2-[4-[2-(2,6-dimethylphenyl)ethynyl]piperidin-1-yl]ethyl]pyridine-3-carboxamide

Systemtic Name: N-[2-[4-[2-(2,6-dimethylphenyl)ethynyl]piperidin-1-yl]ethyl]pyridine-3-carboxamide Openeye Name: N-[2-[4-[2-(2,6-dimethylphenyl)ethynyl]-1-piperidyl]ethyl]pyridine-3-carboxamide CAS Name: N-[2-[4-[2-(2,6-dimethylphenyl)ethynyl]-1-piperidinyl]ethyl]-3-pyridinecarboxamide IUPAC Name: N-[2-[4-[2-(2,6-dimethylphenyl)ethynyl]piperidin-1-yl]ethyl]pyridine-3-carboxamide Traditional Name: N-[2-[4-[2-(2,6-dimethylphenyl)ethynyl]piperidino]ethyl]nicotinamide Formula: C23H27N3O MolecularWeight: 361.47998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)C#CC2CCN(CC2)CCNC(=O)C3=CN=CC=C3

Isomeric SMILES

CC1=C(C(=CC=C1)C)C#CC2CCN(CC2)CCNC(=O)C3=CN=CC=C3

InChI

InChI=1S/C23H27N3O/c1-18-5-3-6-19(2)22(18)9-8-20-10-14-26(15-11-20)16-13-25-23(27)21-7-4-12-24-17-21/h3-7,12,17,20H,10-11,13-16H2,1-2H3,(H,25,27)