ethyl 2-azanyl-6-(hydroxymethyl)-4-(7-methoxy-1,3-benzodioxol-5-yl)-8-oxidanylidene-4H-pyrano[3,2-b]pyran-3-carboxylate

Systemtic Name: ethyl 2-azanyl-6-(hydroxymethyl)-4-(7-methoxy-1,3-benzodioxol-5-yl)-8-oxidanylidene-4H-pyrano[3,2-b]pyran-3-carboxylate Openeye Name: ethyl 2-amino-6-(hydroxymethyl)-4-(7-methoxy-1,3-benzodioxol-5-yl)-8-oxo-4H-pyrano[3,2-b]pyran-3-carboxylate CAS Name: 2-amino-6-(hydroxymethyl)-4-(7-methoxy-1,3-benzodioxol-5-yl)-8-oxo-4H-pyrano[3,2-b]pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-6-(hydroxymethyl)-4-(7-methoxy-1,3-benzodioxol-5-yl)-8-oxo-4H-pyrano[3,2-b]pyran-3-carboxylate Traditional Name: 2-amino-8-keto-4-(7-methoxy-1,3-benzodioxol-5-yl)-6-methylol-4H-pyrano[3,2-b]pyran-3-carboxylic acid ethyl ester Formula: C20H19NO9 MolecularWeight: 417.36616

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C(C1C3=CC4=C(C(=C3)OC)OCO4)OC(=CC2=O)CO)N

Isomeric SMILES

CCOC(=O)C1=C(OC2=C(C1C3=CC4=C(C(=C3)OC)OCO4)OC(=CC2=O)CO)N

InChI

InChI=1S/C20H19NO9/c1-3-26-20(24)15-14(9-4-12(25-2)17-13(5-9)27-8-28-17)18-16(30-19(15)21)11(23)6-10(7-22)29-18/h4-6,14,22H,3,7-8,21H2,1-2H3