3-[[[2-methoxy-5-[(E)-3-oxidanidyl-3-oxidanylidene-prop-1-enyl]phenyl]sulfonylamino]methyl]benzoate

Systemtic Name: 3-[[[2-methoxy-5-[(E)-3-oxidanidyl-3-oxidanylidene-prop-1-enyl]phenyl]sulfonylamino]methyl]benzoate Openeye Name: 3-[[[2-methoxy-5-[(E)-3-oxido-3-oxo-prop-1-enyl]phenyl]sulfonylamino]methyl]benzoate CAS Name: 3-[[[2-methoxy-5-[(E)-3-oxido-3-oxoprop-1-enyl]phenyl]sulfonylamino]methyl]benzoate IUPAC Name: 3-[[[2-methoxy-5-[(E)-3-oxido-3-oxoprop-1-enyl]phenyl]sulfonylamino]methyl]benzoate Traditional Name: 3-[[[5-[(E)-3-keto-3-oxido-prop-1-enyl]-2-methoxy-phenyl]sulfonylamino]methyl]benzoate Formula: C18H15NO7S-2 MolecularWeight: 389.3792

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)[O-])S(=O)(=O)NCC2=CC=CC(=C2)C(=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)[O-])S(=O)(=O)NCC2=CC=CC(=C2)C(=O)[O-]

InChI

InChI=1S/C18H17NO7S/c1-26-15-7-5-12(6-8-17(20)21)10-16(15)27(24,25)19-11-13-3-2-4-14(9-13)18(22)23/h2-10,19H,11H2,1H3,(H,20,21)(H,22,23)/p-2/b8-6+