methyl 1-[2-(3-phenylpropylsulfonyl)ethanoylamino]cyclohexane-1-carboxylate

Systemtic Name: methyl 1-[2-(3-phenylpropylsulfonyl)ethanoylamino]cyclohexane-1-carboxylate Openeye Name: methyl 1-[[2-(3-phenylpropylsulfonyl)acetyl]amino]cyclohexanecarboxylate CAS Name: 1-[[1-oxo-2-(3-phenylpropylsulfonyl)ethyl]amino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-[[2-(3-phenylpropylsulfonyl)acetyl]amino]cyclohexane-1-carboxylate Traditional Name: 1-[[2-(3-phenylpropylsulfonyl)acetyl]amino]cyclohexanecarboxylic acid methyl ester Formula: C19H27NO5S MolecularWeight: 381.48638

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCCCC1)NC(=O)CS(=O)(=O)CCCC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1(CCCCC1)NC(=O)CS(=O)(=O)CCCC2=CC=CC=C2

InChI

InChI=1S/C19H27NO5S/c1-25-18(22)19(12-6-3-7-13-19)20-17(21)15-26(23,24)14-8-11-16-9-4-2-5-10-16/h2,4-5,9-10H,3,6-8,11-15H2,1H3,(H,20,21)