1-chloranyl-2-methyl-benzene; 3-[(sulfonylamino)methyl]benzoic acid

Systemtic Name: 1-chloranyl-2-methyl-benzene; 3-[(sulfonylamino)methyl]benzoic acid Openeye Name: 1-chloro-2-methyl-benzene; 3-[(sulfonylamino)methyl]benzoic acid CAS Name: 1-chloro-2-methylbenzene; 3-[(sulfonylamino)methyl]benzoic acid IUPAC Name: 1-chloro-2-methylbenzene; 3-[(sulfonylamino)methyl]benzoic acid Traditional Name: 1-chloro-2-methyl-benzene; 3-[(sulfonylamino)methyl]benzoic acid Formula: C15H14ClNO4S MolecularWeight: 339.79396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1Cl.C1=CC(=CC(=C1)CN=S(=O)=O)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1Cl.C1=CC(=CC(=C1)CN=S(=O)=O)C(=O)O

InChI

InChI=1S/C8H7NO4S.C7H7Cl/c10-8(11)7-3-1-2-6(4-7)5-9-14(12)13;1-6-4-2-3-5-7(6)8/h1-4H,5H2,(H,10,11);2-5H,1H3