ethyl 2-[2-(1,3-benzodioxol-5-yloxy)ethanoylamino]-5-propan-2-yl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(1,3-benzodioxol-5-yloxy)ethanoylamino]-5-propan-2-yl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(1,3-benzodioxol-5-yloxy)acetyl]amino]-5-isopropyl-thiophene-3-carboxylate CAS Name: 2-[[2-(1,3-benzodioxol-5-yloxy)-1-oxoethyl]amino]-5-propan-2-yl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(1,3-benzodioxol-5-yloxy)acetyl]amino]-5-propan-2-ylthiophene-3-carboxylate Traditional Name: 2-[[2-(1,3-benzodioxol-5-yloxy)acetyl]amino]-5-isopropyl-thiophene-3-carboxylic acid ethyl ester Formula: C19H21NO6S MolecularWeight: 391.43814

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C(C)C)NC(=O)COC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C(C)C)NC(=O)COC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C19H21NO6S/c1-4-23-19(22)13-8-16(11(2)3)27-18(13)20-17(21)9-24-12-5-6-14-15(7-12)26-10-25-14/h5-8,11H,4,9-10H2,1-3H3,(H,20,21)