1-[2-[[(1R,2S)-2-methylcyclohexyl]carbamoylamino]-2-oxidanylidene-ethyl]-N-(phenylmethyl)piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[2-[[(1R,2S)-2-methylcyclohexyl]carbamoylamino]-2-oxidanylidene-ethyl]-N-(phenylmethyl)piperidin-1-ium-4-carboxamide Openeye Name: N-benzyl-1-[2-[[(1R,2S)-2-methylcyclohexyl]carbamoylamino]-2-oxo-ethyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[2-[[[[(1R,2S)-2-methylcyclohexyl]amino]-oxomethyl]amino]-2-oxoethyl]-N-(phenylmethyl)-4-piperidin-1-iumcarboxamide IUPAC Name: N-benzyl-1-[2-[[(1R,2S)-2-methylcyclohexyl]carbamoylamino]-2-oxoethyl]piperidin-1-ium-4-carboxamide Traditional Name: N-benzyl-1-[2-keto-2-[[(1R,2S)-2-methylcyclohexyl]carbamoylamino]ethyl]piperidin-1-ium-4-carboxamide Formula: C23H35N4O3+ MolecularWeight: 415.549

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)NC(=O)C[NH+]2CCC(CC2)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

C[C@H]1CCCC[C@H]1NC(=O)NC(=O)C[NH+]2CCC(CC2)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C23H34N4O3/c1-17-7-5-6-10-20(17)25-23(30)26-21(28)16-27-13-11-19(12-14-27)22(29)24-15-18-8-3-2-4-9-18/h2-4,8-9,17,19-20H,5-7,10-16H2,1H3,(H,24,29)(H2,25,26,28,30)/p+1/t17-,20+/m0/s1