ethyl 4-aminocarbonyl-5-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonylamino)-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 4-aminocarbonyl-5-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonylamino)-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 4-carbamoyl-5-(2,3-dihydro-1,4-benzodioxine-6-carbonylamino)-3-methyl-thiophene-2-carboxylate CAS Name: 4-carbamoyl-5-[[2,3-dihydro-1,4-benzodioxin-6-yl(oxo)methyl]amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-carbamoyl-5-(2,3-dihydro-1,4-benzodioxine-6-carbonylamino)-3-methylthiophene-2-carboxylate Traditional Name: 4-carbamoyl-5-(2,3-dihydro-1,4-benzodioxin-6-carbonylamino)-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C18H18N2O6S MolecularWeight: 390.41032

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)C2=CC3=C(C=C2)OCCO3)C(=O)N)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)C2=CC3=C(C=C2)OCCO3)C(=O)N)C

InChI

InChI=1S/C18H18N2O6S/c1-3-24-18(23)14-9(2)13(15(19)21)17(27-14)20-16(22)10-4-5-11-12(8-10)26-7-6-25-11/h4-5,8H,3,6-7H2,1-2H3,(H2,19,21)(H,20,22)