N-cyclohexyl-5-oxidanylidene-5-(4-pyridin-1-ium-2-ylpiperazin-1-yl)pentanamide

Systemtic Name: N-cyclohexyl-5-oxidanylidene-5-(4-pyridin-1-ium-2-ylpiperazin-1-yl)pentanamide Openeye Name: N-cyclohexyl-5-oxo-5-(4-pyridin-1-ium-2-ylpiperazin-1-yl)pentanamide CAS Name: N-cyclohexyl-5-oxo-5-[4-(2-pyridin-1-iumyl)-1-piperazinyl]pentanamide IUPAC Name: N-cyclohexyl-5-oxo-5-(4-pyridin-1-ium-2-ylpiperazin-1-yl)pentanamide Traditional Name: N-cyclohexyl-5-keto-5-(4-pyridin-1-ium-2-ylpiperazino)valeramide Formula: C20H31N4O2+ MolecularWeight: 359.48574

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)CCCC(=O)N2CCN(CC2)C3=CC=CC=[NH+]3

Isomeric SMILES

C1CCC(CC1)NC(=O)CCCC(=O)N2CCN(CC2)C3=CC=CC=[NH+]3

InChI

InChI=1S/C20H30N4O2/c25-19(22-17-7-2-1-3-8-17)10-6-11-20(26)24-15-13-23(14-16-24)18-9-4-5-12-21-18/h4-5,9,12,17H,1-3,6-8,10-11,13-16H2,(H,22,25)/p+1