methyl 6-azanyl-4-(4-bromophenyl)-5-cyano-2-(2-methoxy-2-oxidanylidene-ethyl)-4H-pyran-3-carboxylate

Systemtic Name: methyl 6-azanyl-4-(4-bromophenyl)-5-cyano-2-(2-methoxy-2-oxidanylidene-ethyl)-4H-pyran-3-carboxylate Openeye Name: methyl 6-amino-4-(4-bromophenyl)-5-cyano-2-(2-methoxy-2-oxo-ethyl)-4H-pyran-3-carboxylate CAS Name: 6-amino-4-(4-bromophenyl)-5-cyano-2-(2-methoxy-2-oxoethyl)-4H-pyran-3-carboxylic acid methyl ester IUPAC Name: methyl 6-amino-4-(4-bromophenyl)-5-cyano-2-(2-methoxy-2-oxoethyl)-4H-pyran-3-carboxylate Traditional Name: 6-amino-4-(4-bromophenyl)-5-cyano-2-(2-keto-2-methoxy-ethyl)-4H-pyran-3-carboxylic acid methyl ester Formula: C17H15BrN2O5 MolecularWeight: 407.2154

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=C(C(C(=C(O1)N)C#N)C2=CC=C(C=C2)Br)C(=O)OC

Isomeric SMILES

COC(=O)CC1=C(C(C(=C(O1)N)C#N)C2=CC=C(C=C2)Br)C(=O)OC

InChI

InChI=1S/C17H15BrN2O5/c1-23-13(21)7-12-15(17(22)24-2)14(11(8-19)16(20)25-12)9-3-5-10(18)6-4-9/h3-6,14H,7,20H2,1-2H3