methyl 1-[(4-chloranyl-3-morpholin-4-ylsulfonyl-phenyl)carbonylamino]cyclohexane-1-carboxylate

Systemtic Name: methyl 1-[(4-chloranyl-3-morpholin-4-ylsulfonyl-phenyl)carbonylamino]cyclohexane-1-carboxylate Openeye Name: methyl 1-[(4-chloro-3-morpholinosulfonyl-benzoyl)amino]cyclohexanecarboxylate CAS Name: 1-[[[4-chloro-3-(4-morpholinylsulfonyl)phenyl]-oxomethyl]amino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-[(4-chloro-3-morpholin-4-ylsulfonylbenzoyl)amino]cyclohexane-1-carboxylate Traditional Name: 1-[(4-chloro-3-morpholinosulfonyl-benzoyl)amino]cyclohexanecarboxylic acid methyl ester Formula: C19H25ClN2O6S MolecularWeight: 444.9296

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCCCC1)NC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCOCC3

Isomeric SMILES

COC(=O)C1(CCCCC1)NC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C19H25ClN2O6S/c1-27-18(24)19(7-3-2-4-8-19)21-17(23)14-5-6-15(20)16(13-14)29(25,26)22-9-11-28-12-10-22/h5-6,13H,2-4,7-12H2,1H3,(H,21,23)