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

Systemtic Name: methyl 6-azanyl-5-cyano-2-(2-methoxy-2-oxidanylidene-ethyl)-4-(3-methoxy-4-oxidanyl-phenyl)-4H-pyran-3-carboxylate Openeye Name: methyl 6-amino-5-cyano-4-(4-hydroxy-3-methoxy-phenyl)-2-(2-methoxy-2-oxo-ethyl)-4H-pyran-3-carboxylate CAS Name: 6-amino-5-cyano-4-(4-hydroxy-3-methoxyphenyl)-2-(2-methoxy-2-oxoethyl)-4H-pyran-3-carboxylic acid methyl ester IUPAC Name: methyl 6-amino-5-cyano-4-(4-hydroxy-3-methoxyphenyl)-2-(2-methoxy-2-oxoethyl)-4H-pyran-3-carboxylate Traditional Name: 6-amino-5-cyano-4-(4-hydroxy-3-methoxy-phenyl)-2-(2-keto-2-methoxy-ethyl)-4H-pyran-3-carboxylic acid methyl ester Formula: C18H18N2O7 MolecularWeight: 374.34472

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2C(=C(OC(=C2C(=O)OC)CC(=O)OC)N)C#N)O

Isomeric SMILES

COC1=C(C=CC(=C1)C2C(=C(OC(=C2C(=O)OC)CC(=O)OC)N)C#N)O

InChI

InChI=1S/C18H18N2O7/c1-24-12-6-9(4-5-11(12)21)15-10(8-19)17(20)27-13(7-14(22)25-2)16(15)18(23)26-3/h4-6,15,21H,7,20H2,1-3H3