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

Systemtic Name: [2-(cyclooctylamino)-2-oxidanylidene-ethyl] 2,4,5-trimethoxybenzoate Openeye Name: [2-(cyclooctylamino)-2-oxo-ethyl] 2,4,5-trimethoxybenzoate CAS Name: 2,4,5-trimethoxybenzoic acid [2-(cyclooctylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclooctylamino)-2-oxoethyl] 2,4,5-trimethoxybenzoate Traditional Name: 2,4,5-trimethoxybenzoic acid [2-(cyclooctylamino)-2-keto-ethyl] ester Formula: C20H29NO6 MolecularWeight: 379.44736

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)OCC(=O)NC2CCCCCCC2)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)OCC(=O)NC2CCCCCCC2)OC)OC

InChI

InChI=1S/C20H29NO6/c1-24-16-12-18(26-3)17(25-2)11-15(16)20(23)27-13-19(22)21-14-9-7-5-4-6-8-10-14/h11-12,14H,4-10,13H2,1-3H3,(H,21,22)