3-methoxy-4-(sulfonylamino)benzenesulfonic acid; 2-methylaniline

Systemtic Name: 3-methoxy-4-(sulfonylamino)benzenesulfonic acid; 2-methylaniline Openeye Name: 3-methoxy-4-(sulfonylamino)benzenesulfonic acid; 2-methylaniline CAS Name: 3-methoxy-4-(sulfonylamino)benzenesulfonic acid; 2-methylaniline IUPAC Name: 3-methoxy-4-(sulfonylamino)benzenesulfonic acid; 2-methylaniline Traditional Name: 3-methoxy-4-(sulfonylamino)besylic acid; o-toluidine Formula: C14H16N2O6S2 MolecularWeight: 372.41664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N.COC1=C(C=CC(=C1)S(=O)(=O)O)N=S(=O)=O

Isomeric SMILES

CC1=CC=CC=C1N.COC1=C(C=CC(=C1)S(=O)(=O)O)N=S(=O)=O

InChI

InChI=1S/C7H7NO6S2.C7H9N/c1-14-7-4-5(16(11,12)13)2-3-6(7)8-15(9)10;1-6-4-2-3-5-7(6)8/h2-4H,1H3,(H,11,12,13);2-5H,8H2,1H3