3-azanyl-2-methoxy-4-oxidanyl-5-(phenylcarbonyl)benzenesulfonic acid

Systemtic Name: 3-azanyl-2-methoxy-4-oxidanyl-5-(phenylcarbonyl)benzenesulfonic acid Openeye Name: 3-amino-5-benzoyl-4-hydroxy-2-methoxy-benzenesulfonic acid CAS Name: 3-amino-5-benzoyl-4-hydroxy-2-methoxybenzenesulfonic acid IUPAC Name: 3-amino-5-benzoyl-4-hydroxy-2-methoxybenzenesulfonic acid Traditional Name: 3-amino-5-benzoyl-4-hydroxy-2-methoxy-besylic acid Formula: C14H13NO6S MolecularWeight: 323.32112

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1N)O)C(=O)C2=CC=CC=C2)S(=O)(=O)O

Isomeric SMILES

COC1=C(C=C(C(=C1N)O)C(=O)C2=CC=CC=C2)S(=O)(=O)O

InChI

InChI=1S/C14H13NO6S/c1-21-14-10(22(18,19)20)7-9(13(17)11(14)15)12(16)8-5-3-2-4-6-8/h2-7,17H,15H2,1H3,(H,18,19,20)