N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ium-4-yl-ethyl]-3-(phenylsulfonylamino)benzamide

Systemtic Name: N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ium-4-yl-ethyl]-3-(phenylsulfonylamino)benzamide Openeye Name: 3-(benzenesulfonamido)-N-[(1R)-2-morpholin-4-ium-4-yl-1-(p-tolyl)ethyl]benzamide CAS Name: 3-(benzenesulfonamido)-N-[(1R)-1-(4-methylphenyl)-2-(4-morpholin-4-iumyl)ethyl]benzamide IUPAC Name: 3-(benzenesulfonamido)-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ium-4-ylethyl]benzamide Traditional Name: 3-(benzenesulfonamido)-N-[(1R)-2-morpholin-4-ium-4-yl-1-(p-tolyl)ethyl]benzamide Formula: C26H30N3O4S+ MolecularWeight: 480.5991

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C[NH+]2CCOCC2)NC(=O)C3=CC(=CC=C3)NS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](C[NH+]2CCOCC2)NC(=O)C3=CC(=CC=C3)NS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H29N3O4S/c1-20-10-12-21(13-11-20)25(19-29-14-16-33-17-15-29)27-26(30)22-6-5-7-23(18-22)28-34(31,32)24-8-3-2-4-9-24/h2-13,18,25,28H,14-17,19H2,1H3,(H,27,30)/p+1/t25-/m0/s1