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

Systemtic Name: 2-chloranyl-N-[3-[(1-morpholin-4-ium-4-ylcyclohexyl)methylamino]-3-oxidanylidene-propyl]benzamide Openeye Name: 2-chloro-N-[3-[(1-morpholin-4-ium-4-ylcyclohexyl)methylamino]-3-oxo-propyl]benzamide CAS Name: 2-chloro-N-[3-[[1-(4-morpholin-4-iumyl)cyclohexyl]methylamino]-3-oxopropyl]benzamide IUPAC Name: 2-chloro-N-[3-[(1-morpholin-4-ium-4-ylcyclohexyl)methylamino]-3-oxopropyl]benzamide Traditional Name: 2-chloro-N-[3-keto-3-[(1-morpholin-4-ium-4-ylcyclohexyl)methylamino]propyl]benzamide Formula: C21H31ClN3O3+ MolecularWeight: 408.94214

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CNC(=O)CCNC(=O)C2=CC=CC=C2Cl)[NH+]3CCOCC3

Isomeric SMILES

C1CCC(CC1)(CNC(=O)CCNC(=O)C2=CC=CC=C2Cl)[NH+]3CCOCC3

InChI

InChI=1S/C21H30ClN3O3/c22-18-7-3-2-6-17(18)20(27)23-11-8-19(26)24-16-21(9-4-1-5-10-21)25-12-14-28-15-13-25/h2-3,6-7H,1,4-5,8-16H2,(H,23,27)(H,24,26)/p+1