[(E)-3-(4-chlorophenyl)prop-2-enyl]-[[2-[2-hydroxyethyl-(4-methoxyphenyl)sulfonyl-amino]phenyl]methyl]-methyl-azanium

Systemtic Name: [(E)-3-(4-chlorophenyl)prop-2-enyl]-[[2-[2-hydroxyethyl-(4-methoxyphenyl)sulfonyl-amino]phenyl]methyl]-methyl-azanium Openeye Name: [(E)-3-(4-chlorophenyl)allyl]-[[2-[2-hydroxyethyl-(4-methoxyphenyl)sulfonyl-amino]phenyl]methyl]-methyl-ammonium CAS Name: [(E)-3-(4-chlorophenyl)prop-2-enyl]-[[2-[2-hydroxyethyl-(4-methoxyphenyl)sulfonylamino]phenyl]methyl]-methylammonium IUPAC Name: [(E)-3-(4-chlorophenyl)prop-2-enyl]-[[2-[2-hydroxyethyl-(4-methoxyphenyl)sulfonylamino]phenyl]methyl]-methylazanium Traditional Name: [(E)-3-(4-chlorophenyl)allyl]-[2-[2-hydroxyethyl-(4-methoxyphenyl)sulfonyl-amino]benzyl]-methyl-ammonium Formula: C26H30ClN2O4S+ MolecularWeight: 502.0454

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC=CC1=CC=C(C=C1)Cl)CC2=CC=CC=C2N(CCO)S(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

C[NH+](C/C=C/C1=CC=C(C=C1)Cl)CC2=CC=CC=C2N(CCO)S(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C26H29ClN2O4S/c1-28(17-5-6-21-9-11-23(27)12-10-21)20-22-7-3-4-8-26(22)29(18-19-30)34(31,32)25-15-13-24(33-2)14-16-25/h3-16,30H,17-20H2,1-2H3/p+1/b6-5+