(3S)-1-(1-cyclopropylcarbonylpiperidin-4-yl)-N-[2-(4-methylphenyl)ethyl]piperidin-1-ium-3-carboxamide

Systemtic Name: (3S)-1-(1-cyclopropylcarbonylpiperidin-4-yl)-N-[2-(4-methylphenyl)ethyl]piperidin-1-ium-3-carboxamide Openeye Name: (3S)-1-[1-(cyclopropanecarbonyl)-4-piperidyl]-N-[2-(p-tolyl)ethyl]piperidin-1-ium-3-carboxamide CAS Name: (3S)-1-[1-[cyclopropyl(oxo)methyl]-4-piperidinyl]-N-[2-(4-methylphenyl)ethyl]-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-1-[1-(cyclopropanecarbonyl)piperidin-4-yl]-N-[2-(4-methylphenyl)ethyl]piperidin-1-ium-3-carboxamide Traditional Name: (3S)-1-[1-(cyclopropanecarbonyl)-4-piperidyl]-N-[2-(p-tolyl)ethyl]piperidin-1-ium-3-carboxamide Formula: C24H36N3O2+ MolecularWeight: 398.56154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CCNC(=O)C2CCC[NH+](C2)C3CCN(CC3)C(=O)C4CC4

Isomeric SMILES

CC1=CC=C(C=C1)CCNC(=O)[C@H]2CCC[NH+](C2)C3CCN(CC3)C(=O)C4CC4

InChI

InChI=1S/C24H35N3O2/c1-18-4-6-19(7-5-18)10-13-25-23(28)21-3-2-14-27(17-21)22-11-15-26(16-12-22)24(29)20-8-9-20/h4-7,20-22H,2-3,8-17H2,1H3,(H,25,28)/p+1/t21-/m0/s1