(3S)-1-[(2R)-1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl]piperidin-1-ium-3-carboxamide

Systemtic Name: (3S)-1-[(2R)-1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl]piperidin-1-ium-3-carboxamide Openeye Name: (3S)-1-[(1R)-2-(cyclohexylamino)-1-methyl-2-oxo-ethyl]piperidin-1-ium-3-carboxamide CAS Name: (3S)-1-[(2R)-1-(cyclohexylamino)-1-oxopropan-2-yl]-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-1-[(2R)-1-(cyclohexylamino)-1-oxopropan-2-yl]piperidin-1-ium-3-carboxamide Traditional Name: (3S)-1-[(1R)-2-(cyclohexylamino)-2-keto-1-methyl-ethyl]piperidin-1-ium-3-carboxamide Formula: C15H28N3O2+ MolecularWeight: 282.40172

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCCC1)[NH+]2CCCC(C2)C(=O)N

Isomeric SMILES

C[C@H](C(=O)NC1CCCCC1)[NH+]2CCC[C@@H](C2)C(=O)N

InChI

InChI=1S/C15H27N3O2/c1-11(15(20)17-13-7-3-2-4-8-13)18-9-5-6-12(10-18)14(16)19/h11-13H,2-10H2,1H3,(H2,16,19)(H,17,20)/p+1/t11-,12+/m1/s1