3-chloranyl-4-[(4-chlorophenyl)methylamino]-5-methylsulfonyl-benzoic acid

Systemtic Name: 3-chloranyl-4-[(4-chlorophenyl)methylamino]-5-methylsulfonyl-benzoic acid Openeye Name: 3-chloro-4-[(4-chlorophenyl)methylamino]-5-methylsulfonyl-benzoic acid CAS Name: 3-chloro-4-[(4-chlorophenyl)methylamino]-5-methylsulfonylbenzoic acid IUPAC Name: 3-chloro-4-[(4-chlorophenyl)methylamino]-5-methylsulfonylbenzoic acid Traditional Name: 3-chloro-4-[(4-chlorobenzyl)amino]-5-mesyl-benzoic acid Formula: C15H13Cl2NO4S MolecularWeight: 374.23902

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C(=CC(=C1)C(=O)O)Cl)NCC2=CC=C(C=C2)Cl

Isomeric SMILES

CS(=O)(=O)C1=C(C(=CC(=C1)C(=O)O)Cl)NCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C15H13Cl2NO4S/c1-23(21,22)13-7-10(15(19)20)6-12(17)14(13)18-8-9-2-4-11(16)5-3-9/h2-7,18H,8H2,1H3,(H,19,20)