N-(furan-2-ylmethyl)-2-(1-hept-2-ynoylpiperidin-4-yl)-N,6-dimethyl-pyridine-3-carboxamide

Systemtic Name: N-(furan-2-ylmethyl)-2-(1-hept-2-ynoylpiperidin-4-yl)-N,6-dimethyl-pyridine-3-carboxamide Openeye Name: N-(2-furylmethyl)-2-(1-hept-2-ynoyl-4-piperidyl)-N,6-dimethyl-pyridine-3-carboxamide CAS Name: N-(2-furanylmethyl)-N,6-dimethyl-2-[1-(1-oxohept-2-ynyl)-4-piperidinyl]-3-pyridinecarboxamide IUPAC Name: N-(furan-2-ylmethyl)-2-(1-hept-2-ynoylpiperidin-4-yl)-N,6-dimethylpyridine-3-carboxamide Traditional Name: N-(2-furfuryl)-2-(1-hept-2-ynoyl-4-piperidyl)-N,6-dimethyl-nicotinamide Formula: C25H31N3O3 MolecularWeight: 421.53194

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC(=O)N1CCC(CC1)C2=C(C=CC(=N2)C)C(=O)N(C)CC3=CC=CO3

Isomeric SMILES

CCCCC#CC(=O)N1CCC(CC1)C2=C(C=CC(=N2)C)C(=O)N(C)CC3=CC=CO3

InChI

InChI=1S/C25H31N3O3/c1-4-5-6-7-10-23(29)28-15-13-20(14-16-28)24-22(12-11-19(2)26-24)25(30)27(3)18-21-9-8-17-31-21/h8-9,11-12,17,20H,4-6,13-16,18H2,1-3H3