[7-(ethoxycarbonylamino)-2-oxidanylidene-chromen-4-yl]methyl 5-bromanylthiophene-2-carboxylate

Systemtic Name: [7-(ethoxycarbonylamino)-2-oxidanylidene-chromen-4-yl]methyl 5-bromanylthiophene-2-carboxylate Openeye Name: [7-(ethoxycarbonylamino)-2-oxo-chromen-4-yl]methyl 5-bromothiophene-2-carboxylate CAS Name: 5-bromo-2-thiophenecarboxylic acid [7-(ethoxycarbonylamino)-2-oxo-1-benzopyran-4-yl]methyl ester IUPAC Name: [7-(ethoxycarbonylamino)-2-oxochromen-4-yl]methyl 5-bromothiophene-2-carboxylate Traditional Name: 5-bromothiophene-2-carboxylic acid [7-(carbethoxyamino)-2-keto-chromen-4-yl]methyl ester Formula: C18H14BrNO6S MolecularWeight: 452.27586

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CC=C(S3)Br

Isomeric SMILES

CCOC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C18H14BrNO6S/c1-2-24-18(23)20-11-3-4-12-10(7-16(21)26-13(12)8-11)9-25-17(22)14-5-6-15(19)27-14/h3-8H,2,9H2,1H3,(H,20,23)