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

Systemtic Name: methyl 6-azanyl-5-cyano-4-(4-cyanophenyl)-2-(2-methoxy-2-oxidanylidene-ethyl)-4H-pyran-3-carboxylate Openeye Name: methyl 6-amino-5-cyano-4-(4-cyanophenyl)-2-(2-methoxy-2-oxo-ethyl)-4H-pyran-3-carboxylate CAS Name: 6-amino-5-cyano-4-(4-cyanophenyl)-2-(2-methoxy-2-oxoethyl)-4H-pyran-3-carboxylic acid methyl ester IUPAC Name: methyl 6-amino-5-cyano-4-(4-cyanophenyl)-2-(2-methoxy-2-oxoethyl)-4H-pyran-3-carboxylate Traditional Name: 6-amino-5-cyano-4-(4-cyanophenyl)-2-(2-keto-2-methoxy-ethyl)-4H-pyran-3-carboxylic acid methyl ester Formula: C18H15N3O5 MolecularWeight: 353.3288

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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)C#N)C(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C18H15N3O5/c1-24-14(22)7-13-16(18(23)25-2)15(12(9-20)17(21)26-13)11-5-3-10(8-19)4-6-11/h3-6,15H,7,21H2,1-2H3