methyl 7-chloranylisoquinoline-3-carboxylate

Systemtic Name: methyl 7-chloranylisoquinoline-3-carboxylate Openeye Name: methyl 7-chloroisoquinoline-3-carboxylate CAS Name: 7-chloro-3-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 7-chloroisoquinoline-3-carboxylate Traditional Name: 7-chloroisoquinoline-3-carboxylic acid methyl ester Formula: C11H8ClNO2 MolecularWeight: 221.63972

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NC=C2C=C(C=CC2=C1)Cl

Isomeric SMILES

COC(=O)C1=NC=C2C=C(C=CC2=C1)Cl

InChI

InChI=1S/C11H8ClNO2/c1-15-11(14)10-5-7-2-3-9(12)4-8(7)6-13-10/h2-6H,1H3