(2S)-N-(cyclohexylcarbamoyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]propanamide

Systemtic Name: (2S)-N-(cyclohexylcarbamoyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]propanamide Openeye Name: (2S)-N-(cyclohexylcarbamoyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]propanamide CAS Name: (2S)-N-[(cyclohexylamino)-oxomethyl]-2-[(3S)-3-methyl-1-piperidin-1-iumyl]propanamide IUPAC Name: (2S)-N-(cyclohexylcarbamoyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]propanamide Traditional Name: (2S)-N-(cyclohexylcarbamoyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]propionamide Formula: C16H30N3O2+ MolecularWeight: 296.4283

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)C(C)C(=O)NC(=O)NC2CCCCC2

Isomeric SMILES

C[C@H]1CCC[NH+](C1)[C@@H](C)C(=O)NC(=O)NC2CCCCC2

InChI

InChI=1S/C16H29N3O2/c1-12-7-6-10-19(11-12)13(2)15(20)18-16(21)17-14-8-4-3-5-9-14/h12-14H,3-11H2,1-2H3,(H2,17,18,20,21)/p+1/t12-,13-/m0/s1