[2-[(6-ethanoyl-1,3-benzodioxol-5-yl)amino]-2-oxidanylidene-ethyl] 5-(furan-2-ylcarbonylamino)thiophene-2-carboxylate

Systemtic Name: [2-[(6-ethanoyl-1,3-benzodioxol-5-yl)amino]-2-oxidanylidene-ethyl] 5-(furan-2-ylcarbonylamino)thiophene-2-carboxylate Openeye Name: [2-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-2-oxo-ethyl] 5-(furan-2-carbonylamino)thiophene-2-carboxylate CAS Name: 5-[[2-furanyl(oxo)methyl]amino]-2-thiophenecarboxylic acid [2-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-2-oxoethyl] 5-(furan-2-carbonylamino)thiophene-2-carboxylate Traditional Name: 5-(2-furoylamino)thiophene-2-carboxylic acid [2-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-2-keto-ethyl] ester Formula: C21H16N2O8S MolecularWeight: 456.42534

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1NC(=O)COC(=O)C3=CC=C(S3)NC(=O)C4=CC=CO4)OCO2

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1NC(=O)COC(=O)C3=CC=C(S3)NC(=O)C4=CC=CO4)OCO2

InChI

InChI=1S/C21H16N2O8S/c1-11(24)12-7-15-16(31-10-30-15)8-13(12)22-18(25)9-29-21(27)17-4-5-19(32-17)23-20(26)14-3-2-6-28-14/h2-8H,9-10H2,1H3,(H,22,25)(H,23,26)