N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]-4-[(propan-2-ylcarbamoylamino)methyl]benzamide

Systemtic Name: N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]-4-[(propan-2-ylcarbamoylamino)methyl]benzamide Openeye Name: 4-[(isopropylcarbamoylamino)methyl]-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]benzamide CAS Name: 4-[[[oxo-(propan-2-ylamino)methyl]amino]methyl]-N-[[1-(1-piperidin-1-iumyl)cyclohexyl]methyl]benzamide IUPAC Name: N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]-4-[(propan-2-ylcarbamoylamino)methyl]benzamide Traditional Name: 4-[(isopropylcarbamoylamino)methyl]-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]benzamide Formula: C24H39N4O2+ MolecularWeight: 415.59206

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)NCC2(CCCCC2)[NH+]3CCCCC3

Isomeric SMILES

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)NCC2(CCCCC2)[NH+]3CCCCC3

InChI

InChI=1S/C24H38N4O2/c1-19(2)27-23(30)25-17-20-9-11-21(12-10-20)22(29)26-18-24(13-5-3-6-14-24)28-15-7-4-8-16-28/h9-12,19H,3-8,13-18H2,1-2H3,(H,26,29)(H2,25,27,30)/p+1