1-[(2S)-1-(cyclohexylcarbamoylamino)-1-oxidanylidene-propan-2-yl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(2S)-1-(cyclohexylcarbamoylamino)-1-oxidanylidene-propan-2-yl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(1S)-2-(cyclohexylcarbamoylamino)-1-methyl-2-oxo-ethyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[(2S)-1-[[(cyclohexylamino)-oxomethyl]amino]-1-oxopropan-2-yl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(2S)-1-(cyclohexylcarbamoylamino)-1-oxopropan-2-yl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[(1S)-2-(cyclohexylcarbamoylamino)-2-keto-1-methyl-ethyl]piperidin-1-ium-4-carboxamide Formula: C16H29N4O3+ MolecularWeight: 325.42646

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC1CCCCC1)[NH+]2CCC(CC2)C(=O)N

Isomeric SMILES

C[C@@H](C(=O)NC(=O)NC1CCCCC1)[NH+]2CCC(CC2)C(=O)N

InChI

InChI=1S/C16H28N4O3/c1-11(20-9-7-12(8-10-20)14(17)21)15(22)19-16(23)18-13-5-3-2-4-6-13/h11-13H,2-10H2,1H3,(H2,17,21)(H2,18,19,22,23)/p+1/t11-/m0/s1