benzenesulfonamide; 3-(2-methylprop-2-enoylamino)benzenesulfonic acid

Systemtic Name: benzenesulfonamide; 3-(2-methylprop-2-enoylamino)benzenesulfonic acid Openeye Name: benzenesulfonamide; 3-(2-methylprop-2-enoylamino)benzenesulfonic acid CAS Name: benzenesulfonamide; 3-[(2-methyl-1-oxoprop-2-enyl)amino]benzenesulfonic acid IUPAC Name: benzenesulfonamide; 3-(2-methylprop-2-enoylamino)benzenesulfonic acid Traditional Name: benzenesulfonamide; 3-methacrylamidobesylic acid Formula: C16H18N2O6S2 MolecularWeight: 398.45392

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(=O)NC1=CC(=CC=C1)S(=O)(=O)O.C1=CC=C(C=C1)S(=O)(=O)N

Isomeric SMILES

CC(=C)C(=O)NC1=CC(=CC=C1)S(=O)(=O)O.C1=CC=C(C=C1)S(=O)(=O)N

InChI

InChI=1S/C10H11NO4S.C6H7NO2S/c1-7(2)10(12)11-8-4-3-5-9(6-8)16(13,14)15;7-10(8,9)6-4-2-1-3-5-6/h3-6H,1H2,2H3,(H,11,12)(H,13,14,15);1-5H,(H2,7,8,9)