methyl 3-methyl-4-[(4-morpholin-4-ylsulfonylphenyl)sulfonylamino]benzoate

Systemtic Name: methyl 3-methyl-4-[(4-morpholin-4-ylsulfonylphenyl)sulfonylamino]benzoate Openeye Name: methyl 3-methyl-4-[(4-morpholinosulfonylphenyl)sulfonylamino]benzoate CAS Name: 3-methyl-4-[[4-(4-morpholinylsulfonyl)phenyl]sulfonylamino]benzoic acid methyl ester IUPAC Name: methyl 3-methyl-4-[(4-morpholin-4-ylsulfonylphenyl)sulfonylamino]benzoate Traditional Name: 3-methyl-4-[(4-morpholinosulfonylphenyl)sulfonylamino]benzoic acid methyl ester Formula: C19H22N2O7S2 MolecularWeight: 454.51718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)OC)NS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)OC)NS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C19H22N2O7S2/c1-14-13-15(19(22)27-2)3-8-18(14)20-29(23,24)16-4-6-17(7-5-16)30(25,26)21-9-11-28-12-10-21/h3-8,13,20H,9-12H2,1-2H3