[2-(dicyclohexylamino)-2-oxidanylidene-ethyl] 2-methyl-5-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: [2-(dicyclohexylamino)-2-oxidanylidene-ethyl] 2-methyl-5-morpholin-4-ylsulfonyl-benzoate Openeye Name: [2-(dicyclohexylamino)-2-oxo-ethyl] 2-methyl-5-morpholinosulfonyl-benzoate CAS Name: 2-methyl-5-(4-morpholinylsulfonyl)benzoic acid [2-(dicyclohexylamino)-2-oxoethyl] ester IUPAC Name: [2-(dicyclohexylamino)-2-oxoethyl] 2-methyl-5-morpholin-4-ylsulfonylbenzoate Traditional Name: 2-methyl-5-morpholinosulfonyl-benzoic acid [2-(dicyclohexylamino)-2-keto-ethyl] ester Formula: C26H38N2O6S MolecularWeight: 506.65472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)OCC(=O)N(C3CCCCC3)C4CCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)OCC(=O)N(C3CCCCC3)C4CCCCC4

InChI

InChI=1S/C26H38N2O6S/c1-20-12-13-23(35(31,32)27-14-16-33-17-15-27)18-24(20)26(30)34-19-25(29)28(21-8-4-2-5-9-21)22-10-6-3-7-11-22/h12-13,18,21-22H,2-11,14-17,19H2,1H3