ethyl 2-[2-[3-(1,3-benzodioxol-5-yl)prop-2-enoyloxy]ethanoylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[3-(1,3-benzodioxol-5-yl)prop-2-enoyloxy]ethanoylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[3-(1,3-benzodioxol-5-yl)prop-2-enoyloxy]acetyl]amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[2-[3-(1,3-benzodioxol-5-yl)-1-oxoprop-2-enoxy]-1-oxoethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[3-(1,3-benzodioxol-5-yl)prop-2-enoyloxy]acetyl]amino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[[2-[3-(1,3-benzodioxol-5-yl)acryloyl]oxyacetyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C21H21NO7S MolecularWeight: 431.45894

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)COC(=O)C=CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)COC(=O)C=CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C21H21NO7S/c1-4-26-21(25)19-12(2)13(3)30-20(19)22-17(23)10-27-18(24)8-6-14-5-7-15-16(9-14)29-11-28-15/h5-9H,4,10-11H2,1-3H3,(H,22,23)