2-azanyl-4-[3,4-bis(oxidanyl)phenyl]-7-methyl-5-oxidanylidene-4H-pyrano[3,2-c]pyran-3-carbonitrile

Systemtic Name: 2-azanyl-4-[3,4-bis(oxidanyl)phenyl]-7-methyl-5-oxidanylidene-4H-pyrano[3,2-c]pyran-3-carbonitrile Openeye Name: 2-amino-4-(3,4-dihydroxyphenyl)-7-methyl-5-oxo-4H-pyrano[3,2-c]pyran-3-carbonitrile CAS Name: 2-amino-4-(3,4-dihydroxyphenyl)-7-methyl-5-oxo-4H-pyrano[3,2-c]pyran-3-carbonitrile IUPAC Name: 2-amino-4-(3,4-dihydroxyphenyl)-7-methyl-5-oxo-4H-pyrano[3,2-c]pyran-3-carbonitrile Traditional Name: 2-amino-4-(3,4-dihydroxyphenyl)-5-keto-7-methyl-4H-pyrano[3,2-c]pyran-3-carbonitrile Formula: C16H12N2O5 MolecularWeight: 312.27688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(C(=C(O2)N)C#N)C3=CC(=C(C=C3)O)O)C(=O)O1

Isomeric SMILES

CC1=CC2=C(C(C(=C(O2)N)C#N)C3=CC(=C(C=C3)O)O)C(=O)O1

InChI

InChI=1S/C16H12N2O5/c1-7-4-12-14(16(21)22-7)13(9(6-17)15(18)23-12)8-2-3-10(19)11(20)5-8/h2-5,13,19-20H,18H2,1H3