(2-methyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-yl) 3,4,5-trimethoxybenzoate

Systemtic Name: (2-methyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-yl) 3,4,5-trimethoxybenzoate Openeye Name: (2-methyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-yl) 3,4,5-trimethoxybenzoate CAS Name: 3,4,5-trimethoxybenzoic acid (2-methyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-yl) ester IUPAC Name: (2-methyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-yl) 3,4,5-trimethoxybenzoate Traditional Name: 3,4,5-trimethoxybenzoic acid (2-methyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-yl) ester Formula: C20H29NO5 MolecularWeight: 363.44796

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2C(C1)CCCC2OC(=O)C3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

CN1CCC2C(C1)CCCC2OC(=O)C3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C20H29NO5/c1-21-9-8-15-13(12-21)6-5-7-16(15)26-20(22)14-10-17(23-2)19(25-4)18(11-14)24-3/h10-11,13,15-16H,5-9,12H2,1-4H3