[2-(cycloheptylamino)-2-oxidanylidene-ethyl] 3,4,5-trimethoxybenzoate

Systemtic Name: [2-(cycloheptylamino)-2-oxidanylidene-ethyl] 3,4,5-trimethoxybenzoate Openeye Name: [2-(cycloheptylamino)-2-oxo-ethyl] 3,4,5-trimethoxybenzoate CAS Name: 3,4,5-trimethoxybenzoic acid [2-(cycloheptylamino)-2-oxoethyl] ester IUPAC Name: [2-(cycloheptylamino)-2-oxoethyl] 3,4,5-trimethoxybenzoate Traditional Name: 3,4,5-trimethoxybenzoic acid [2-(cycloheptylamino)-2-keto-ethyl] ester Formula: C19H27NO6 MolecularWeight: 365.42078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)OCC(=O)NC2CCCCCC2

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)OCC(=O)NC2CCCCCC2

InChI

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