(2R)-2-(azocan-1-ium-1-yl)-N-[2-(4-sulfamoylphenyl)ethyl]propanamide

Systemtic Name: (2R)-2-(azocan-1-ium-1-yl)-N-[2-(4-sulfamoylphenyl)ethyl]propanamide Openeye Name: (2R)-2-(azocan-1-ium-1-yl)-N-[2-(4-sulfamoylphenyl)ethyl]propanamide CAS Name: (2R)-2-(1-azocan-1-iumyl)-N-[2-(4-sulfamoylphenyl)ethyl]propanamide IUPAC Name: (2R)-2-(azocan-1-ium-1-yl)-N-[2-(4-sulfamoylphenyl)ethyl]propanamide Traditional Name: (2R)-2-(azocan-1-ium-1-yl)-N-[2-(4-sulfamoylphenyl)ethyl]propionamide Formula: C18H30N3O3S+ MolecularWeight: 368.5141

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCC1=CC=C(C=C1)S(=O)(=O)N)[NH+]2CCCCCCC2

Isomeric SMILES

C[C@H](C(=O)NCCC1=CC=C(C=C1)S(=O)(=O)N)[NH+]2CCCCCCC2

InChI

InChI=1S/C18H29N3O3S/c1-15(21-13-5-3-2-4-6-14-21)18(22)20-12-11-16-7-9-17(10-8-16)25(19,23)24/h7-10,15H,2-6,11-14H2,1H3,(H,20,22)(H2,19,23,24)/p+1/t15-/m1/s1