N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-2-methyl-pyridine-3-carboxamide

Systemtic Name: N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-2-methyl-pyridine-3-carboxamide Openeye Name: N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-2-methyl-pyridine-3-carboxamide CAS Name: N-[(3S)-1-cycloheptyl-3-piperidin-1-iumyl]-2-methyl-3-pyridinecarboxamide IUPAC Name: N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-2-methylpyridine-3-carboxamide Traditional Name: N-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-2-methyl-nicotinamide Formula: C19H30N3O+ MolecularWeight: 316.461

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=N1)C(=O)NC2CCC[NH+](C2)C3CCCCCC3

Isomeric SMILES

CC1=C(C=CC=N1)C(=O)N[C@H]2CCC[NH+](C2)C3CCCCCC3

InChI

InChI=1S/C19H29N3O/c1-15-18(11-6-12-20-15)19(23)21-16-8-7-13-22(14-16)17-9-4-2-3-5-10-17/h6,11-12,16-17H,2-5,7-10,13-14H2,1H3,(H,21,23)/p+1/t16-/m0/s1