2-methanoylbenzenesulfonic acid; 4-methylaniline

Systemtic Name: 2-methanoylbenzenesulfonic acid; 4-methylaniline Openeye Name: 2-formylbenzenesulfonic acid; 4-methylaniline CAS Name: 2-formylbenzenesulfonic acid; 4-methylaniline IUPAC Name: 2-formylbenzenesulfonic acid; 4-methylaniline Traditional Name: 2-formylbesylic acid; p-toluidine Formula: C14H15NO4S MolecularWeight: 293.3382

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H9N.C7H6O4S/c1-6-2-4-7(8)5-3-6;8-5-6-3-1-2-4-7(6)12(9,10)11/h2-5H,8H2,1H3;1-5H,(H,9,10,11)