2-azanyl-4-(2,5-dimethylphenyl)-6-(hydroxymethyl)-8-oxidanylidene-4H-pyrano[3,2-b]pyran-3-carbonitrile

Systemtic Name: 2-azanyl-4-(2,5-dimethylphenyl)-6-(hydroxymethyl)-8-oxidanylidene-4H-pyrano[3,2-b]pyran-3-carbonitrile Openeye Name: 2-amino-4-(2,5-dimethylphenyl)-6-(hydroxymethyl)-8-oxo-4H-pyrano[3,2-b]pyran-3-carbonitrile CAS Name: 2-amino-4-(2,5-dimethylphenyl)-6-(hydroxymethyl)-8-oxo-4H-pyrano[3,2-b]pyran-3-carbonitrile IUPAC Name: 2-amino-4-(2,5-dimethylphenyl)-6-(hydroxymethyl)-8-oxo-4H-pyrano[3,2-b]pyran-3-carbonitrile Traditional Name: 2-amino-4-(2,5-dimethylphenyl)-8-keto-6-methylol-4H-pyrano[3,2-b]pyran-3-carbonitrile Formula: C18H16N2O4 MolecularWeight: 324.33064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2C(=C(OC3=C2OC(=CC3=O)CO)N)C#N

Isomeric SMILES

CC1=CC(=C(C=C1)C)C2C(=C(OC3=C2OC(=CC3=O)CO)N)C#N

InChI

InChI=1S/C18H16N2O4/c1-9-3-4-10(2)12(5-9)15-13(7-19)18(20)24-16-14(22)6-11(8-21)23-17(15)16/h3-6,15,21H,8,20H2,1-2H3