butyl 5-oxidanylisoquinoline-1-carboxylate

Systemtic Name: butyl 5-oxidanylisoquinoline-1-carboxylate Openeye Name: butyl 5-hydroxyisoquinoline-1-carboxylate CAS Name: 5-hydroxy-1-isoquinolinecarboxylic acid butyl ester IUPAC Name: butyl 5-hydroxyisoquinoline-1-carboxylate Traditional Name: 5-hydroxyisoquinoline-1-carboxylic acid butyl ester Formula: C14H15NO3 MolecularWeight: 245.2738

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=NC=CC2=C1C=CC=C2O

Isomeric SMILES

CCCCOC(=O)C1=NC=CC2=C1C=CC=C2O

InChI

InChI=1S/C14H15NO3/c1-2-3-9-18-14(17)13-11-5-4-6-12(16)10(11)7-8-15-13/h4-8,16H,2-3,9H2,1H3