methyl 6-isoquinolin-1-ylhexanoate

Systemtic Name: methyl 6-isoquinolin-1-ylhexanoate Openeye Name: methyl 6-(1-isoquinolyl)hexanoate CAS Name: 6-(1-isoquinolinyl)hexanoic acid methyl ester IUPAC Name: methyl 6-isoquinolin-1-ylhexanoate Traditional Name: 6-(1-isoquinolyl)hexanoic acid methyl ester Formula: C16H19NO2 MolecularWeight: 257.32756

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCC1=NC=CC2=CC=CC=C21

Isomeric SMILES

COC(=O)CCCCCC1=NC=CC2=CC=CC=C21

InChI

InChI=1S/C16H19NO2/c1-19-16(18)10-4-2-3-9-15-14-8-6-5-7-13(14)11-12-17-15/h5-8,11-12H,2-4,9-10H2,1H3