ethyl 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbonylamino)-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbonylamino)-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-(3,4-dihydro-2H-1,5-benzodioxepine-7-carbonylamino)-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[3,4-dihydro-2H-1,5-benzodioxepin-7-yl(oxo)methyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(3,4-dihydro-2H-1,5-benzodioxepine-7-carbonylamino)-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-carbonylamino)-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C19H21NO5S MolecularWeight: 375.43874

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C19H21NO5S/c1-4-23-19(22)16-11(2)12(3)26-18(16)20-17(21)13-6-7-14-15(10-13)25-9-5-8-24-14/h6-7,10H,4-5,8-9H2,1-3H3,(H,20,21)