(4S)-2-azanyl-6-(hydroxymethyl)-4-(3-methoxy-4-propan-2-yloxy-phenyl)-8-oxidanylidene-4H-pyrano[3,2-b]pyran-3-carbonitrile

Systemtic Name: (4S)-2-azanyl-6-(hydroxymethyl)-4-(3-methoxy-4-propan-2-yloxy-phenyl)-8-oxidanylidene-4H-pyrano[3,2-b]pyran-3-carbonitrile Openeye Name: (4S)-2-amino-6-(hydroxymethyl)-4-(4-isopropoxy-3-methoxy-phenyl)-8-oxo-4H-pyrano[3,2-b]pyran-3-carbonitrile CAS Name: (4S)-2-amino-6-(hydroxymethyl)-4-(3-methoxy-4-propan-2-yloxyphenyl)-8-oxo-4H-pyrano[3,2-b]pyran-3-carbonitrile IUPAC Name: (4S)-2-amino-6-(hydroxymethyl)-4-(3-methoxy-4-propan-2-yloxyphenyl)-8-oxo-4H-pyrano[3,2-b]pyran-3-carbonitrile Traditional Name: (4S)-2-amino-4-(4-isopropoxy-3-methoxy-phenyl)-8-keto-6-methylol-4H-pyrano[3,2-b]pyran-3-carbonitrile Formula: C20H20N2O6 MolecularWeight: 384.3826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)C2C(=C(OC3=C2OC(=CC3=O)CO)N)C#N)OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)[C@H]2C(=C(OC3=C2OC(=CC3=O)CO)N)C#N)OC

InChI

InChI=1S/C20H20N2O6/c1-10(2)26-15-5-4-11(6-16(15)25-3)17-13(8-21)20(22)28-18-14(24)7-12(9-23)27-19(17)18/h4-7,10,17,23H,9,22H2,1-3H3/t17-/m0/s1