methyl 7-isoquinolin-1-ylheptanoate

Systemtic Name: methyl 7-isoquinolin-1-ylheptanoate Openeye Name: methyl 7-(1-isoquinolyl)heptanoate CAS Name: 7-(1-isoquinolinyl)heptanoic acid methyl ester IUPAC Name: methyl 7-isoquinolin-1-ylheptanoate Traditional Name: 7-(1-isoquinolyl)enanthic acid methyl ester Formula: C17H21NO2 MolecularWeight: 271.35414

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCCC1=NC=CC2=CC=CC=C21

Isomeric SMILES

COC(=O)CCCCCCC1=NC=CC2=CC=CC=C21

InChI

InChI=1S/C17H21NO2/c1-20-17(19)11-5-3-2-4-10-16-15-9-7-6-8-14(15)12-13-18-16/h6-9,12-13H,2-5,10-11H2,1H3