(3S)-N-cyclopropyl-1-[1-(4-methylpentanoyl)piperidin-4-yl]piperidin-1-ium-3-carboxamide

Systemtic Name: (3S)-N-cyclopropyl-1-[1-(4-methylpentanoyl)piperidin-4-yl]piperidin-1-ium-3-carboxamide Openeye Name: (3S)-N-cyclopropyl-1-[1-(4-methylpentanoyl)-4-piperidyl]piperidin-1-ium-3-carboxamide CAS Name: (3S)-N-cyclopropyl-1-[1-(4-methyl-1-oxopentyl)-4-piperidinyl]-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-N-cyclopropyl-1-[1-(4-methylpentanoyl)piperidin-4-yl]piperidin-1-ium-3-carboxamide Traditional Name: (3S)-N-cyclopropyl-1-[1-(4-methylpentanoyl)-4-piperidyl]piperidin-1-ium-3-carboxamide Formula: C20H36N3O2+ MolecularWeight: 350.51874

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=O)N1CCC(CC1)[NH+]2CCCC(C2)C(=O)NC3CC3

Isomeric SMILES

CC(C)CCC(=O)N1CCC(CC1)[NH+]2CCC[C@@H](C2)C(=O)NC3CC3

InChI

InChI=1S/C20H35N3O2/c1-15(2)5-8-19(24)22-12-9-18(10-13-22)23-11-3-4-16(14-23)20(25)21-17-6-7-17/h15-18H,3-14H2,1-2H3,(H,21,25)/p+1/t16-/m0/s1