[1-oxidanylidene-1-(phenethylamino)propan-2-yl] 2,4,5-trimethoxybenzoate

Systemtic Name: [1-oxidanylidene-1-(phenethylamino)propan-2-yl] 2,4,5-trimethoxybenzoate Openeye Name: [1-methyl-2-oxo-2-(phenethylamino)ethyl] 2,4,5-trimethoxybenzoate CAS Name: 2,4,5-trimethoxybenzoic acid [1-oxo-1-(phenethylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(phenethylamino)propan-2-yl] 2,4,5-trimethoxybenzoate Traditional Name: 2,4,5-trimethoxybenzoic acid [2-keto-1-methyl-2-(phenethylamino)ethyl] ester Formula: C21H25NO6 MolecularWeight: 387.4263

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCC1=CC=CC=C1)OC(=O)C2=CC(=C(C=C2OC)OC)OC

Isomeric SMILES

CC(C(=O)NCCC1=CC=CC=C1)OC(=O)C2=CC(=C(C=C2OC)OC)OC

InChI

InChI=1S/C21H25NO6/c1-14(20(23)22-11-10-15-8-6-5-7-9-15)28-21(24)16-12-18(26-3)19(27-4)13-17(16)25-2/h5-9,12-14H,10-11H2,1-4H3,(H,22,23)