2-(4-acetamido-2-methyl-phenyl)-5-(methylamino)benzenesulfonic acid

Systemtic Name: 2-(4-acetamido-2-methyl-phenyl)-5-(methylamino)benzenesulfonic acid Openeye Name: 2-(4-acetamido-2-methyl-phenyl)-5-(methylamino)benzenesulfonic acid CAS Name: 2-(4-acetamido-2-methylphenyl)-5-(methylamino)benzenesulfonic acid IUPAC Name: 2-(4-acetamido-2-methylphenyl)-5-(methylamino)benzenesulfonic acid Traditional Name: 2-(4-acetamido-2-methyl-phenyl)-5-(methylamino)besylic acid Formula: C16H18N2O4S MolecularWeight: 334.39012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C)C2=C(C=C(C=C2)NC)S(=O)(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C)C2=C(C=C(C=C2)NC)S(=O)(=O)O

InChI

InChI=1S/C16H18N2O4S/c1-10-8-13(18-11(2)19)5-6-14(10)15-7-4-12(17-3)9-16(15)23(20,21)22/h4-9,17H,1-3H3,(H,18,19)(H,20,21,22)