ethyl 2-ethoxy-1H-isoquinoline-1-carboxylate

Systemtic Name: ethyl 2-ethoxy-1H-isoquinoline-1-carboxylate Openeye Name: ethyl 2-ethoxy-1H-isoquinoline-1-carboxylate CAS Name: 2-ethoxy-1H-isoquinoline-1-carboxylic acid ethyl ester IUPAC Name: ethyl 2-ethoxy-1H-isoquinoline-1-carboxylate Traditional Name: 2-ethoxy-1H-isoquinoline-1-carboxylic acid ethyl ester Formula: C14H17NO3 MolecularWeight: 247.28968

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C2=CC=CC=C2C=CN1OCC

Isomeric SMILES

CCOC(=O)C1C2=CC=CC=C2C=CN1OCC

InChI

InChI=1S/C14H17NO3/c1-3-17-14(16)13-12-8-6-5-7-11(12)9-10-15(13)18-4-2/h5-10,13H,3-4H2,1-2H3