ethyl 2-azanyl-6,8-bis(bromanyl)-2-(1-cyano-2-ethoxy-2-oxidanylidene-ethyl)chromene-3-carboxylate

Systemtic Name: ethyl 2-azanyl-6,8-bis(bromanyl)-2-(1-cyano-2-ethoxy-2-oxidanylidene-ethyl)chromene-3-carboxylate Openeye Name: ethyl 2-amino-6,8-dibromo-2-(1-cyano-2-ethoxy-2-oxo-ethyl)chromene-3-carboxylate CAS Name: 2-amino-6,8-dibromo-2-(1-cyano-2-ethoxy-2-oxoethyl)-1-benzopyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-6,8-dibromo-2-(1-cyano-2-ethoxy-2-oxoethyl)chromene-3-carboxylate Traditional Name: 2-amino-6,8-dibromo-2-(1-cyano-2-ethoxy-2-keto-ethyl)chromene-3-carboxylic acid ethyl ester Formula: C17H16Br2N2O5 MolecularWeight: 488.12734

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=CC(=CC(=C2OC1(C(C#N)C(=O)OCC)N)Br)Br

Isomeric SMILES

CCOC(=O)C1=CC2=CC(=CC(=C2OC1(C(C#N)C(=O)OCC)N)Br)Br

InChI

InChI=1S/C17H16Br2N2O5/c1-3-24-15(22)11-6-9-5-10(18)7-13(19)14(9)26-17(11,21)12(8-20)16(23)25-4-2/h5-7,12H,3-4,21H2,1-2H3