(E)-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ium-4-yl-ethyl]-2-phenyl-ethenesulfonamide

Systemtic Name: (E)-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ium-4-yl-ethyl]-2-phenyl-ethenesulfonamide Openeye Name: (E)-N-[(1R)-2-morpholin-4-ium-4-yl-1-(p-tolyl)ethyl]-2-phenyl-ethenesulfonamide CAS Name: (E)-N-[(1R)-1-(4-methylphenyl)-2-(4-morpholin-4-iumyl)ethyl]-2-phenylethenesulfonamide IUPAC Name: (E)-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ium-4-ylethyl]-2-phenylethenesulfonamide Traditional Name: (E)-N-[(1R)-2-morpholin-4-ium-4-yl-1-(p-tolyl)ethyl]-2-phenyl-ethenesulfonamide Formula: C21H27N2O3S+ MolecularWeight: 387.51568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C[NH+]2CCOCC2)NS(=O)(=O)C=CC3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O3S/c1-18-7-9-20(10-8-18)21(17-23-12-14-26-15-13-23)22-27(24,25)16-11-19-5-3-2-4-6-19/h2-11,16,21-22H,12-15,17H2,1H3/p+1/b16-11+/t21-/m0/s1