[2-[2-cyanoethyl(methyl)amino]-2-oxidanylidene-ethyl] 6-bromanyl-2-oxidanylidene-chromene-3-carboxylate

Systemtic Name: [2-[2-cyanoethyl(methyl)amino]-2-oxidanylidene-ethyl] 6-bromanyl-2-oxidanylidene-chromene-3-carboxylate Openeye Name: [2-[2-cyanoethyl(methyl)amino]-2-oxo-ethyl] 6-bromo-2-oxo-chromene-3-carboxylate CAS Name: 6-bromo-2-oxo-1-benzopyran-3-carboxylic acid [2-[2-cyanoethyl(methyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[2-cyanoethyl(methyl)amino]-2-oxoethyl] 6-bromo-2-oxochromene-3-carboxylate Traditional Name: 6-bromo-2-keto-chromene-3-carboxylic acid [2-[2-cyanoethyl(methyl)amino]-2-keto-ethyl] ester Formula: C16H13BrN2O5 MolecularWeight: 393.18882

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)C(=O)COC(=O)C1=CC2=C(C=CC(=C2)Br)OC1=O

Isomeric SMILES

CN(CCC#N)C(=O)COC(=O)C1=CC2=C(C=CC(=C2)Br)OC1=O

InChI

InChI=1S/C16H13BrN2O5/c1-19(6-2-5-18)14(20)9-23-15(21)12-8-10-7-11(17)3-4-13(10)24-16(12)22/h3-4,7-8H,2,6,9H2,1H3