methyl 4-azanyl-1-oxidanyl-5-(phenylsulfonyl)cyclohexa-2,4-diene-1-carboxylate

Systemtic Name: methyl 4-azanyl-1-oxidanyl-5-(phenylsulfonyl)cyclohexa-2,4-diene-1-carboxylate Openeye Name: methyl 4-amino-5-(benzenesulfonyl)-1-hydroxy-cyclohexa-2,4-diene-1-carboxylate CAS Name: 4-amino-5-(benzenesulfonyl)-1-hydroxy-1-cyclohexa-2,4-dienecarboxylic acid methyl ester IUPAC Name: methyl 4-amino-5-(benzenesulfonyl)-1-hydroxycyclohexa-2,4-diene-1-carboxylate Traditional Name: 4-amino-5-besyl-1-hydroxy-cyclohexa-2,4-diene-1-carboxylic acid methyl ester Formula: C14H15NO5S MolecularWeight: 309.3376

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CC(=C(C=C1)N)S(=O)(=O)C2=CC=CC=C2)O

Isomeric SMILES

COC(=O)C1(CC(=C(C=C1)N)S(=O)(=O)C2=CC=CC=C2)O

InChI

InChI=1S/C14H15NO5S/c1-20-13(16)14(17)8-7-11(15)12(9-14)21(18,19)10-5-3-2-4-6-10/h2-8,17H,9,15H2,1H3