(3-azanyl-5-methyl-phenyl) benzenesulfonate

Systemtic Name: (3-azanyl-5-methyl-phenyl) benzenesulfonate Openeye Name: (3-amino-5-methyl-phenyl) benzenesulfonate CAS Name: benzenesulfonic acid (3-amino-5-methylphenyl) ester IUPAC Name: (3-amino-5-methylphenyl) benzenesulfonate Traditional Name: benzenesulfonic acid (3-amino-5-methyl-phenyl) ester Formula: C13H13NO3S MolecularWeight: 263.31222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OS(=O)(=O)C2=CC=CC=C2)N

Isomeric SMILES

CC1=CC(=CC(=C1)OS(=O)(=O)C2=CC=CC=C2)N

InChI

InChI=1S/C13H13NO3S/c1-10-7-11(14)9-12(8-10)17-18(15,16)13-5-3-2-4-6-13/h2-9H,14H2,1H3