(2-methoxy-4-prop-2-enyl-phenyl) 3-sulfamoylbenzenesulfonate

Systemtic Name: (2-methoxy-4-prop-2-enyl-phenyl) 3-sulfamoylbenzenesulfonate Openeye Name: (4-allyl-2-methoxy-phenyl) 3-sulfamoylbenzenesulfonate CAS Name: 3-sulfamoylbenzenesulfonic acid (2-methoxy-4-prop-2-enylphenyl) ester IUPAC Name: (2-methoxy-4-prop-2-enylphenyl) 3-sulfamoylbenzenesulfonate Traditional Name: 3-sulfamoylbenzenesulfonic acid (4-allyl-2-methoxy-phenyl) ester Formula: C16H17NO6S2 MolecularWeight: 383.43928

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CC=C)OS(=O)(=O)C2=CC=CC(=C2)S(=O)(=O)N

Isomeric SMILES

COC1=C(C=CC(=C1)CC=C)OS(=O)(=O)C2=CC=CC(=C2)S(=O)(=O)N

InChI

InChI=1S/C16H17NO6S2/c1-3-5-12-8-9-15(16(10-12)22-2)23-25(20,21)14-7-4-6-13(11-14)24(17,18)19/h3-4,6-11H,1,5H2,2H3,(H2,17,18,19)