4-(4-methylphenyl)sulfonyl-3-(2-nitrophenyl)sulfonyl-but-2-en-1-ol

Systemtic Name: 4-(4-methylphenyl)sulfonyl-3-(2-nitrophenyl)sulfonyl-but-2-en-1-ol Openeye Name: 3-(2-nitrophenyl)sulfonyl-4-(p-tolylsulfonyl)but-2-en-1-ol CAS Name: 4-(4-methylphenyl)sulfonyl-3-(2-nitrophenyl)sulfonyl-2-buten-1-ol IUPAC Name: 4-(4-methylphenyl)sulfonyl-3-(2-nitrophenyl)sulfonylbut-2-en-1-ol Traditional Name: 3-(2-nitrophenyl)sulfonyl-4-tosyl-but-2-en-1-ol Formula: C17H17NO7S2 MolecularWeight: 411.44938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC(=CCO)S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC(=CCO)S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C17H17NO7S2/c1-13-6-8-14(9-7-13)26(22,23)12-15(10-11-19)27(24,25)17-5-3-2-4-16(17)18(20)21/h2-10,19H,11-12H2,1H3