methyl 4-azanyl-3-(phenylsulfonyl)benzoate

Systemtic Name: methyl 4-azanyl-3-(phenylsulfonyl)benzoate Openeye Name: methyl 4-amino-3-(benzenesulfonyl)benzoate CAS Name: 4-amino-3-(benzenesulfonyl)benzoic acid methyl ester IUPAC Name: methyl 4-amino-3-(benzenesulfonyl)benzoate Traditional Name: 4-amino-3-besyl-benzoic acid methyl ester Formula: C14H13NO4S MolecularWeight: 291.32232

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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

Isomeric SMILES

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

InChI

InChI=1S/C14H13NO4S/c1-19-14(16)10-7-8-12(15)13(9-10)20(17,18)11-5-3-2-4-6-11/h2-9H,15H2,1H3