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

Systemtic Name: ethyl 2-[2-(1,3-benzodioxol-5-yloxy)ethanoylamino]-5-ethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(1,3-benzodioxol-5-yloxy)acetyl]amino]-5-ethyl-thiophene-3-carboxylate CAS Name: 2-[[2-(1,3-benzodioxol-5-yloxy)-1-oxoethyl]amino]-5-ethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(1,3-benzodioxol-5-yloxy)acetyl]amino]-5-ethylthiophene-3-carboxylate Traditional Name: 2-[[2-(1,3-benzodioxol-5-yloxy)acetyl]amino]-5-ethyl-thiophene-3-carboxylic acid ethyl ester Formula: C18H19NO6S MolecularWeight: 377.41156

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)COC2=CC3=C(C=C2)OCO3)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)COC2=CC3=C(C=C2)OCO3)C(=O)OCC

InChI

InChI=1S/C18H19NO6S/c1-3-12-8-13(18(21)22-4-2)17(26-12)19-16(20)9-23-11-5-6-14-15(7-11)25-10-24-14/h5-8H,3-4,9-10H2,1-2H3,(H,19,20)