methyl 3-azanyl-4-chloranyl-2-methyl-5-methylsulfonyl-benzoate

Systemtic Name: methyl 3-azanyl-4-chloranyl-2-methyl-5-methylsulfonyl-benzoate Openeye Name: methyl 3-amino-4-chloro-2-methyl-5-methylsulfonyl-benzoate CAS Name: 3-amino-4-chloro-2-methyl-5-methylsulfonylbenzoic acid methyl ester IUPAC Name: methyl 3-amino-4-chloro-2-methyl-5-methylsulfonylbenzoate Traditional Name: 3-amino-4-chloro-5-mesyl-2-methyl-benzoic acid methyl ester Formula: C10H12ClNO4S MolecularWeight: 277.72458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1C(=O)OC)S(=O)(=O)C)Cl)N

Isomeric SMILES

CC1=C(C(=C(C=C1C(=O)OC)S(=O)(=O)C)Cl)N

InChI

InChI=1S/C10H12ClNO4S/c1-5-6(10(13)16-2)4-7(17(3,14)15)8(11)9(5)12/h4H,12H2,1-3H3