methyl 6-azanyl-5-cyano-4-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]-2-(2-methoxy-2-oxidanylidene-ethyl)-4H-pyran-3-carboxylate

Systemtic Name: methyl 6-azanyl-5-cyano-4-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]-2-(2-methoxy-2-oxidanylidene-ethyl)-4H-pyran-3-carboxylate Openeye Name: methyl 6-amino-5-cyano-4-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]-2-(2-methoxy-2-oxo-ethyl)-4H-pyran-3-carboxylate CAS Name: 6-amino-5-cyano-4-[4-methoxy-3-[(4-nitro-1-pyrazolyl)methyl]phenyl]-2-(2-methoxy-2-oxoethyl)-4H-pyran-3-carboxylic acid methyl ester IUPAC Name: methyl 6-amino-5-cyano-4-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]-2-(2-methoxy-2-oxoethyl)-4H-pyran-3-carboxylate Traditional Name: 6-amino-5-cyano-2-(2-keto-2-methoxy-ethyl)-4-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]-4H-pyran-3-carboxylic acid methyl ester Formula: C22H21N5O8 MolecularWeight: 483.43084

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2C(=C(OC(=C2C(=O)OC)CC(=O)OC)N)C#N)CN3C=C(C=N3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C2C(=C(OC(=C2C(=O)OC)CC(=O)OC)N)C#N)CN3C=C(C=N3)[N+](=O)[O-]

InChI

InChI=1S/C22H21N5O8/c1-32-16-5-4-12(6-13(16)10-26-11-14(9-25-26)27(30)31)19-15(8-23)21(24)35-17(7-18(28)33-2)20(19)22(29)34-3/h4-6,9,11,19H,7,10,24H2,1-3H3