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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H35N3O2/c1-20(2,3)13-18(24)22-11-8-17(9-12-22)23-10-4-5-15(14-23)19(25)21-16-6-7-16/h15-17H,4-14H2,1-3H3,(H,21,25)/p+1/t15-/m0/s1