3-(3-methylphenoxy)-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]propanamide

Systemtic Name: 3-(3-methylphenoxy)-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]propanamide Openeye Name: 3-(3-methylphenoxy)-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]propanamide CAS Name: 3-(3-methylphenoxy)-N-[[1-(4-morpholin-4-iumyl)cyclohexyl]methyl]propanamide IUPAC Name: 3-(3-methylphenoxy)-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]propanamide Traditional Name: 3-(3-methylphenoxy)-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]propionamide Formula: C21H33N2O3+ MolecularWeight: 361.49832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCC(=O)NCC2(CCCCC2)[NH+]3CCOCC3

Isomeric SMILES

CC1=CC(=CC=C1)OCCC(=O)NCC2(CCCCC2)[NH+]3CCOCC3

InChI

InChI=1S/C21H32N2O3/c1-18-6-5-7-19(16-18)26-13-8-20(24)22-17-21(9-3-2-4-10-21)23-11-14-25-15-12-23/h5-7,16H,2-4,8-15,17H2,1H3,(H,22,24)/p+1