[1-oxidanylidene-1-(thiophen-2-ylmethylamino)propan-2-yl] 2,3,4-trimethoxybenzoate

Systemtic Name: [1-oxidanylidene-1-(thiophen-2-ylmethylamino)propan-2-yl] 2,3,4-trimethoxybenzoate Openeye Name: [1-methyl-2-oxo-2-(2-thienylmethylamino)ethyl] 2,3,4-trimethoxybenzoate CAS Name: 2,3,4-trimethoxybenzoic acid [1-oxo-1-(thiophen-2-ylmethylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(thiophen-2-ylmethylamino)propan-2-yl] 2,3,4-trimethoxybenzoate Traditional Name: 2,3,4-trimethoxybenzoic acid [2-keto-1-methyl-2-(2-thenylamino)ethyl] ester Formula: C18H21NO6S MolecularWeight: 379.42744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CS1)OC(=O)C2=C(C(=C(C=C2)OC)OC)OC

Isomeric SMILES

CC(C(=O)NCC1=CC=CS1)OC(=O)C2=C(C(=C(C=C2)OC)OC)OC

InChI

InChI=1S/C18H21NO6S/c1-11(17(20)19-10-12-6-5-9-26-12)25-18(21)13-7-8-14(22-2)16(24-4)15(13)23-3/h5-9,11H,10H2,1-4H3,(H,19,20)