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

Systemtic Name: (4R)-2-azanyl-4-(4-cyclopentyloxyphenyl)-6-(hydroxymethyl)-8-oxidanylidene-4H-pyrano[3,2-b]pyran-3-carbonitrile Openeye Name: (4R)-2-amino-4-[4-(cyclopentoxy)phenyl]-6-(hydroxymethyl)-8-oxo-4H-pyrano[3,2-b]pyran-3-carbonitrile CAS Name: (4R)-2-amino-4-(4-cyclopentyloxyphenyl)-6-(hydroxymethyl)-8-oxo-4H-pyrano[3,2-b]pyran-3-carbonitrile IUPAC Name: (4R)-2-amino-4-(4-cyclopentyloxyphenyl)-6-(hydroxymethyl)-8-oxo-4H-pyrano[3,2-b]pyran-3-carbonitrile Traditional Name: (4R)-2-amino-4-[4-(cyclopentoxy)phenyl]-8-keto-6-methylol-4H-pyrano[3,2-b]pyran-3-carbonitrile Formula: C21H20N2O5 MolecularWeight: 380.3939

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)OC2=CC=C(C=C2)C3C(=C(OC4=C3OC(=CC4=O)CO)N)C#N

Isomeric SMILES

C1CCC(C1)OC2=CC=C(C=C2)[C@@H]3C(=C(OC4=C3OC(=CC4=O)CO)N)C#N

InChI

InChI=1S/C21H20N2O5/c22-10-16-18(12-5-7-14(8-6-12)26-13-3-1-2-4-13)20-19(28-21(16)23)17(25)9-15(11-24)27-20/h5-9,13,18,24H,1-4,11,23H2/t18-/m1/s1