4-chloranyl-N-[3-oxidanylidene-3-[(1-piperidin-1-ium-1-ylcyclohexyl)methylamino]propyl]benzamide

Systemtic Name: 4-chloranyl-N-[3-oxidanylidene-3-[(1-piperidin-1-ium-1-ylcyclohexyl)methylamino]propyl]benzamide Openeye Name: 4-chloro-N-[3-oxo-3-[(1-piperidin-1-ium-1-ylcyclohexyl)methylamino]propyl]benzamide CAS Name: 4-chloro-N-[3-oxo-3-[[1-(1-piperidin-1-iumyl)cyclohexyl]methylamino]propyl]benzamide IUPAC Name: 4-chloro-N-[3-oxo-3-[(1-piperidin-1-ium-1-ylcyclohexyl)methylamino]propyl]benzamide Traditional Name: 4-chloro-N-[3-keto-3-[(1-piperidin-1-ium-1-ylcyclohexyl)methylamino]propyl]benzamide Formula: C22H33ClN3O2+ MolecularWeight: 406.96932

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CNC(=O)CCNC(=O)C2=CC=C(C=C2)Cl)[NH+]3CCCCC3

Isomeric SMILES

C1CCC(CC1)(CNC(=O)CCNC(=O)C2=CC=C(C=C2)Cl)[NH+]3CCCCC3

InChI

InChI=1S/C22H32ClN3O2/c23-19-9-7-18(8-10-19)21(28)24-14-11-20(27)25-17-22(12-3-1-4-13-22)26-15-5-2-6-16-26/h7-10H,1-6,11-17H2,(H,24,28)(H,25,27)/p+1