4-[(5-chloranyl-3-methyl-1-benzothiophen-2-yl)sulfonylamino]-2-methyl-5-methylsulfonyl-benzoate

Systemtic Name: 4-[(5-chloranyl-3-methyl-1-benzothiophen-2-yl)sulfonylamino]-2-methyl-5-methylsulfonyl-benzoate Openeye Name: 4-[(5-chloro-3-methyl-benzothiophen-2-yl)sulfonylamino]-2-methyl-5-methylsulfonyl-benzoate CAS Name: 4-[(5-chloro-3-methyl-1-benzothiophen-2-yl)sulfonylamino]-2-methyl-5-methylsulfonylbenzoate IUPAC Name: 4-[(5-chloro-3-methyl-1-benzothiophen-2-yl)sulfonylamino]-2-methyl-5-methylsulfonylbenzoate Traditional Name: 4-[(5-chloro-3-methyl-benzothiophen-2-yl)sulfonylamino]-5-mesyl-2-methyl-benzoate Formula: C18H15ClNO6S3- MolecularWeight: 472.9628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)[O-])S(=O)(=O)C)NS(=O)(=O)C2=C(C3=C(S2)C=CC(=C3)Cl)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)[O-])S(=O)(=O)C)NS(=O)(=O)C2=C(C3=C(S2)C=CC(=C3)Cl)C

InChI

InChI=1S/C18H16ClNO6S3/c1-9-6-14(16(28(3,23)24)8-12(9)17(21)22)20-29(25,26)18-10(2)13-7-11(19)4-5-15(13)27-18/h4-8,20H,1-3H3,(H,21,22)/p-1