methyl 3-chloranyl-5-methylsulfonyl-4-phenylazanyl-benzoate

Systemtic Name: methyl 3-chloranyl-5-methylsulfonyl-4-phenylazanyl-benzoate Openeye Name: methyl 4-anilino-3-chloro-5-methylsulfonyl-benzoate CAS Name: 4-anilino-3-chloro-5-methylsulfonylbenzoic acid methyl ester IUPAC Name: methyl 4-anilino-3-chloro-5-methylsulfonylbenzoate Traditional Name: 4-anilino-3-chloro-5-mesyl-benzoic acid methyl ester Formula: C15H14ClNO4S MolecularWeight: 339.79396

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C(=C1)Cl)NC2=CC=CC=C2)S(=O)(=O)C

Isomeric SMILES

COC(=O)C1=CC(=C(C(=C1)Cl)NC2=CC=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C15H14ClNO4S/c1-21-15(18)10-8-12(16)14(13(9-10)22(2,19)20)17-11-6-4-3-5-7-11/h3-9,17H,1-2H3