N-[(3S)-1-(1-methylpiperidin-1-ium-4-yl)piperidin-3-yl]-1-piperidin-1-ium-1-yl-cyclohexane-1-carboxamide

Systemtic Name: N-[(3S)-1-(1-methylpiperidin-1-ium-4-yl)piperidin-3-yl]-1-piperidin-1-ium-1-yl-cyclohexane-1-carboxamide Openeye Name: N-[(3S)-1-(1-methylpiperidin-1-ium-4-yl)-3-piperidyl]-1-piperidin-1-ium-1-yl-cyclohexanecarboxamide CAS Name: N-[(3S)-1-(1-methyl-4-piperidin-1-iumyl)-3-piperidinyl]-1-(1-piperidin-1-iumyl)-1-cyclohexanecarboxamide IUPAC Name: N-[(3S)-1-(1-methylpiperidin-1-ium-4-yl)piperidin-3-yl]-1-piperidin-1-ium-1-ylcyclohexane-1-carboxamide Traditional Name: N-[(3S)-1-(1-methylpiperidin-1-ium-4-yl)-3-piperidyl]-1-piperidin-1-ium-1-yl-cyclohexanecarboxamide Formula: C23H44N4O+2 MolecularWeight: 392.62166

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)N2CCCC(C2)NC(=O)C3(CCCCC3)[NH+]4CCCCC4

Isomeric SMILES

C[NH+]1CCC(CC1)N2CCC[C@@H](C2)NC(=O)C3(CCCCC3)[NH+]4CCCCC4

InChI

InChI=1S/C23H42N4O/c1-25-17-10-21(11-18-25)26-14-8-9-20(19-26)24-22(28)23(12-4-2-5-13-23)27-15-6-3-7-16-27/h20-21H,2-19H2,1H3,(H,24,28)/p+2/t20-/m0/s1