(6-butoxy-4-oxidanyl-1-oxidanylidene-2H-isoquinolin-3-yl) butyl carbonate

Systemtic Name: (6-butoxy-4-oxidanyl-1-oxidanylidene-2H-isoquinolin-3-yl) butyl carbonate Openeye Name: (6-butoxy-4-hydroxy-1-oxo-2H-isoquinolin-3-yl) butyl carbonate CAS Name: carbonic acid (6-butoxy-4-hydroxy-1-oxo-2H-isoquinolin-3-yl) butyl ester IUPAC Name: (6-butoxy-4-hydroxy-1-oxo-2H-isoquinolin-3-yl) butyl carbonate Traditional Name: carbonic acid (6-butoxy-4-hydroxy-1-keto-2H-isoquinolin-3-yl) butyl ester Formula: C18H23NO6 MolecularWeight: 349.37832

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC2=C(C=C1)C(=O)NC(=C2O)OC(=O)OCCCC

Isomeric SMILES

CCCCOC1=CC2=C(C=C1)C(=O)NC(=C2O)OC(=O)OCCCC

InChI

InChI=1S/C18H23NO6/c1-3-5-9-23-12-7-8-13-14(11-12)15(20)17(19-16(13)21)25-18(22)24-10-6-4-2/h7-8,11,20H,3-6,9-10H2,1-2H3,(H,19,21)