1-[2-[(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]cyclohexane-1-carboxylic acid

Systemtic Name: 1-[2-[(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]cyclohexane-1-carboxylic acid Openeye Name: 1-[2-(4-methyl-3-morpholinosulfonyl-anilino)-2-oxo-ethyl]cyclohexanecarboxylic acid CAS Name: 1-[2-[4-methyl-3-(4-morpholinylsulfonyl)anilino]-2-oxoethyl]-1-cyclohexanecarboxylic acid IUPAC Name: 1-[2-(4-methyl-3-morpholin-4-ylsulfonylanilino)-2-oxoethyl]cyclohexane-1-carboxylic acid Traditional Name: 1-[2-keto-2-(4-methyl-3-morpholinosulfonyl-anilino)ethyl]cyclohexanecarboxylic acid Formula: C20H28N2O6S MolecularWeight: 424.51112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CC2(CCCCC2)C(=O)O)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CC2(CCCCC2)C(=O)O)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C20H28N2O6S/c1-15-5-6-16(13-17(15)29(26,27)22-9-11-28-12-10-22)21-18(23)14-20(19(24)25)7-3-2-4-8-20/h5-6,13H,2-4,7-12,14H2,1H3,(H,21,23)(H,24,25)