2-[(2,3-dimethoxyphenyl)methyl-(3-morpholin-4-ylpropyl)carbamoyl]cyclohexane-1-carboxylic acid

Systemtic Name: 2-[(2,3-dimethoxyphenyl)methyl-(3-morpholin-4-ylpropyl)carbamoyl]cyclohexane-1-carboxylic acid Openeye Name: 2-[(2,3-dimethoxyphenyl)methyl-(3-morpholinopropyl)carbamoyl]cyclohexanecarboxylic acid CAS Name: 2-[[(2,3-dimethoxyphenyl)methyl-[3-(4-morpholinyl)propyl]amino]-oxomethyl]-1-cyclohexanecarboxylic acid IUPAC Name: 2-[(2,3-dimethoxyphenyl)methyl-(3-morpholin-4-ylpropyl)carbamoyl]cyclohexane-1-carboxylic acid Traditional Name: 2-[3-morpholinopropyl(o-veratryl)carbamoyl]cyclohexanecarboxylic acid Formula: C24H36N2O6 MolecularWeight: 448.55244

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)CN(CCCN2CCOCC2)C(=O)C3CCCCC3C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1OC)CN(CCCN2CCOCC2)C(=O)C3CCCCC3C(=O)O

InChI

InChI=1S/C24H36N2O6/c1-30-21-10-5-7-18(22(21)31-2)17-26(12-6-11-25-13-15-32-16-14-25)23(27)19-8-3-4-9-20(19)24(28)29/h5,7,10,19-20H,3-4,6,8-9,11-17H2,1-2H3,(H,28,29)