N-[(1S)-1-cyclopropylethyl]-1-[1-[(6-methylpyridin-2-yl)methyl]piperidin-1-ium-4-yl]piperidine-4-carboxamide

Systemtic Name: N-[(1S)-1-cyclopropylethyl]-1-[1-[(6-methylpyridin-2-yl)methyl]piperidin-1-ium-4-yl]piperidine-4-carboxamide Openeye Name: N-[(1S)-1-cyclopropylethyl]-1-[1-[(6-methyl-2-pyridyl)methyl]piperidin-1-ium-4-yl]piperidine-4-carboxamide CAS Name: N-[(1S)-1-cyclopropylethyl]-1-[1-[(6-methyl-2-pyridinyl)methyl]-4-piperidin-1-iumyl]-4-piperidinecarboxamide IUPAC Name: N-[(1S)-1-cyclopropylethyl]-1-[1-[(6-methylpyridin-2-yl)methyl]piperidin-1-ium-4-yl]piperidine-4-carboxamide Traditional Name: N-[(1S)-1-cyclopropylethyl]-1-[1-[(6-methyl-2-pyridyl)methyl]piperidin-1-ium-4-yl]isonipecotamide Formula: C23H37N4O+ MolecularWeight: 385.56608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)C[NH+]2CCC(CC2)N3CCC(CC3)C(=O)NC(C)C4CC4

Isomeric SMILES

CC1=NC(=CC=C1)C[NH+]2CCC(CC2)N3CCC(CC3)C(=O)N[C@@H](C)C4CC4

InChI

InChI=1S/C23H36N4O/c1-17-4-3-5-21(24-17)16-26-12-10-22(11-13-26)27-14-8-20(9-15-27)23(28)25-18(2)19-6-7-19/h3-5,18-20,22H,6-16H2,1-2H3,(H,25,28)/p+1/t18-/m0/s1