methyl 4-(2-azanyl-3-cyano-5-oxidanylidene-4H-pyrano[3,2-c]chromen-4-yl)benzoate

Systemtic Name: methyl 4-(2-azanyl-3-cyano-5-oxidanylidene-4H-pyrano[3,2-c]chromen-4-yl)benzoate Openeye Name: methyl 4-(2-amino-3-cyano-5-oxo-4H-pyrano[3,2-c]chromen-4-yl)benzoate CAS Name: 4-(2-amino-3-cyano-5-oxo-4H-pyrano[3,2-c][1]benzopyran-4-yl)benzoic acid methyl ester IUPAC Name: methyl 4-(2-amino-3-cyano-5-oxo-4H-pyrano[3,2-c]chromen-4-yl)benzoate Traditional Name: 4-(2-amino-3-cyano-5-keto-4H-pyrano[3,2-c]chromen-4-yl)benzoic acid methyl ester Formula: C21H14N2O5 MolecularWeight: 374.34626

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2C(=C(OC3=C2C(=O)OC4=CC=CC=C43)N)C#N

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2C(=C(OC3=C2C(=O)OC4=CC=CC=C43)N)C#N

InChI

InChI=1S/C21H14N2O5/c1-26-20(24)12-8-6-11(7-9-12)16-14(10-22)19(23)28-18-13-4-2-3-5-15(13)27-21(25)17(16)18/h2-9,16H,23H2,1H3