methyl 1-[[(E)-3-[4-(diethylsulfamoyl)phenyl]prop-2-enoyl]amino]cyclohexane-1-carboxylate

Systemtic Name: methyl 1-[[(E)-3-[4-(diethylsulfamoyl)phenyl]prop-2-enoyl]amino]cyclohexane-1-carboxylate Openeye Name: methyl 1-[[(E)-3-[4-(diethylsulfamoyl)phenyl]prop-2-enoyl]amino]cyclohexanecarboxylate CAS Name: 1-[[(E)-3-[4-(diethylsulfamoyl)phenyl]-1-oxoprop-2-enyl]amino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-[[(E)-3-[4-(diethylsulfamoyl)phenyl]prop-2-enoyl]amino]cyclohexane-1-carboxylate Traditional Name: 1-[[(E)-3-[4-(diethylsulfamoyl)phenyl]acryloyl]amino]cyclohexanecarboxylic acid methyl ester Formula: C21H30N2O5S MolecularWeight: 422.5383

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C=CC(=O)NC2(CCCCC2)C(=O)OC

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)/C=C/C(=O)NC2(CCCCC2)C(=O)OC

InChI

InChI=1S/C21H30N2O5S/c1-4-23(5-2)29(26,27)18-12-9-17(10-13-18)11-14-19(24)22-21(20(25)28-3)15-7-6-8-16-21/h9-14H,4-8,15-16H2,1-3H3,(H,22,24)/b14-11+