dimethyl 5-[[1-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]cyclohexyl]carbonylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[[1-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]cyclohexyl]carbonylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[1-[2-(cyclopropylamino)-2-oxo-ethyl]cyclohexanecarbonyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[[1-[2-(cyclopropylamino)-2-oxoethyl]cyclohexyl]-oxomethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[1-[2-(cyclopropylamino)-2-oxoethyl]cyclohexanecarbonyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[1-[2-(cyclopropylamino)-2-keto-ethyl]cyclohexanecarbonyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C22H28N2O6 MolecularWeight: 416.46752

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)C2(CCCCC2)CC(=O)NC3CC3)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)C2(CCCCC2)CC(=O)NC3CC3)C(=O)OC

InChI

InChI=1S/C22H28N2O6/c1-29-19(26)14-10-15(20(27)30-2)12-17(11-14)24-21(28)22(8-4-3-5-9-22)13-18(25)23-16-6-7-16/h10-12,16H,3-9,13H2,1-2H3,(H,23,25)(H,24,28)