(3S)-1-(1-methylpiperidin-1-ium-4-yl)-N-(2-pyridin-2-ylethyl)piperidin-1-ium-3-carboxamide

Systemtic Name: (3S)-1-(1-methylpiperidin-1-ium-4-yl)-N-(2-pyridin-2-ylethyl)piperidin-1-ium-3-carboxamide Openeye Name: (3S)-1-(1-methylpiperidin-1-ium-4-yl)-N-[2-(2-pyridyl)ethyl]piperidin-1-ium-3-carboxamide CAS Name: (3S)-1-(1-methyl-4-piperidin-1-iumyl)-N-[2-(2-pyridinyl)ethyl]-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-1-(1-methylpiperidin-1-ium-4-yl)-N-(2-pyridin-2-ylethyl)piperidin-1-ium-3-carboxamide Traditional Name: (3S)-1-(1-methylpiperidin-1-ium-4-yl)-N-[2-(2-pyridyl)ethyl]piperidin-1-ium-3-carboxamide Formula: C19H32N4O+2 MolecularWeight: 332.48358

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)[NH+]2CCCC(C2)C(=O)NCCC3=CC=CC=N3

Isomeric SMILES

C[NH+]1CCC(CC1)[NH+]2CCC[C@@H](C2)C(=O)NCCC3=CC=CC=N3

InChI

InChI=1S/C19H30N4O/c1-22-13-8-18(9-14-22)23-12-4-5-16(15-23)19(24)21-11-7-17-6-2-3-10-20-17/h2-3,6,10,16,18H,4-5,7-9,11-15H2,1H3,(H,21,24)/p+2/t16-/m0/s1