(2R)-N2-[(2S)-1-azanyl-3-cyclohexyl-1-oxidanylidene-propan-2-yl]-N1-propan-2-yl-piperazin-4-ium-1,2-dicarboxamide

Systemtic Name: (2R)-N2-[(2S)-1-azanyl-3-cyclohexyl-1-oxidanylidene-propan-2-yl]-N1-propan-2-yl-piperazin-4-ium-1,2-dicarboxamide Openeye Name: (2R)-N2-[(1S)-2-amino-1-(cyclohexylmethyl)-2-oxo-ethyl]-N1-isopropyl-piperazin-4-ium-1,2-dicarboxamide CAS Name: (2R)-N2-[(2S)-1-amino-3-cyclohexyl-1-oxopropan-2-yl]-N1-propan-2-ylpiperazin-4-ium-1,2-dicarboxamide IUPAC Name: (2R)-2-N-[(2S)-1-amino-3-cyclohexyl-1-oxopropan-2-yl]-1-N-propan-2-ylpiperazin-4-ium-1,2-dicarboxamide Traditional Name: (2R)-N'-[(1S)-2-amino-1-(cyclohexylmethyl)-2-keto-ethyl]-N-isopropyl-piperazin-4-ium-1,2-dicarboxamide Formula: C18H34N5O3+ MolecularWeight: 368.49426

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)N1CC[NH2+]CC1C(=O)NC(CC2CCCCC2)C(=O)N

Isomeric SMILES

CC(C)NC(=O)N1CC[NH2+]C[C@@H]1C(=O)N[C@@H](CC2CCCCC2)C(=O)N

InChI

InChI=1S/C18H33N5O3/c1-12(2)21-18(26)23-9-8-20-11-15(23)17(25)22-14(16(19)24)10-13-6-4-3-5-7-13/h12-15,20H,3-11H2,1-2H3,(H2,19,24)(H,21,26)(H,22,25)/p+1/t14-,15+/m0/s1