methyl 2-(5-chloranylpentanoyl)-3,4-dihydro-1H-isoquinoline-3-carboxylate

Systemtic Name: methyl 2-(5-chloranylpentanoyl)-3,4-dihydro-1H-isoquinoline-3-carboxylate Openeye Name: methyl 2-(5-chloropentanoyl)-3,4-dihydro-1H-isoquinoline-3-carboxylate CAS Name: 2-(5-chloro-1-oxopentyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl 2-(5-chloropentanoyl)-3,4-dihydro-1H-isoquinoline-3-carboxylate Traditional Name: 2-(5-chloropentanoyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester Formula: C16H20ClNO3 MolecularWeight: 309.7879

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC2=CC=CC=C2CN1C(=O)CCCCCl

Isomeric SMILES

COC(=O)C1CC2=CC=CC=C2CN1C(=O)CCCCCl

InChI

InChI=1S/C16H20ClNO3/c1-21-16(20)14-10-12-6-2-3-7-13(12)11-18(14)15(19)8-4-5-9-17/h2-3,6-7,14H,4-5,8-11H2,1H3