(E)-ethene-1,2-diol; 4-methyl-N-[2-[(2-oxidanyl-3-phenoxy-propyl)amino]ethyl]benzenesulfonamide

Systemtic Name: (E)-ethene-1,2-diol; 4-methyl-N-[2-[(2-oxidanyl-3-phenoxy-propyl)amino]ethyl]benzenesulfonamide Openeye Name: (E)-ethene-1,2-diol; N-[2-[(2-hydroxy-3-phenoxy-propyl)amino]ethyl]-4-methyl-benzenesulfonamide CAS Name: (E)-ethene-1,2-diol; N-[2-[(2-hydroxy-3-phenoxypropyl)amino]ethyl]-4-methylbenzenesulfonamide IUPAC Name: (E)-ethene-1,2-diol; N-[2-[(2-hydroxy-3-phenoxypropyl)amino]ethyl]-4-methylbenzenesulfonamide Traditional Name: (E)-ethene-1,2-diol; N-[2-[(2-hydroxy-3-phenoxy-propyl)amino]ethyl]-4-methyl-benzenesulfonamide Formula: C20H28N2O6S MolecularWeight: 424.51112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCNCC(COC2=CC=CC=C2)O.C(=CO)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCNCC(COC2=CC=CC=C2)O.C(=C/O)\O

InChI

InChI=1S/C18H24N2O4S.C2H4O2/c1-15-7-9-18(10-8-15)25(22,23)20-12-11-19-13-16(21)14-24-17-5-3-2-4-6-17;3-1-2-4/h2-10,16,19-21H,11-14H2,1H3;1-4H/b;2-1+