1-[2-oxidanylidene-2-[(3,4,5-trimethoxyphenyl)amino]ethyl]cycloheptane-1-carboxylic acid

Systemtic Name: 1-[2-oxidanylidene-2-[(3,4,5-trimethoxyphenyl)amino]ethyl]cycloheptane-1-carboxylic acid Openeye Name: 1-[2-oxo-2-(3,4,5-trimethoxyanilino)ethyl]cycloheptanecarboxylic acid CAS Name: 1-[2-oxo-2-(3,4,5-trimethoxyanilino)ethyl]-1-cycloheptanecarboxylic acid IUPAC Name: 1-[2-oxo-2-(3,4,5-trimethoxyanilino)ethyl]cycloheptane-1-carboxylic acid Traditional Name: 1-[2-keto-2-(3,4,5-trimethoxyanilino)ethyl]cycloheptanecarboxylic acid Formula: C19H27NO6 MolecularWeight: 365.42078

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC(=O)CC2(CCCCCC2)C(=O)O

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC(=O)CC2(CCCCCC2)C(=O)O

InChI

InChI=1S/C19H27NO6/c1-24-14-10-13(11-15(25-2)17(14)26-3)20-16(21)12-19(18(22)23)8-6-4-5-7-9-19/h10-11H,4-9,12H2,1-3H3,(H,20,21)(H,22,23)