ethyl 6-bromanylisoquinoline-3-carboxylate

Systemtic Name: ethyl 6-bromanylisoquinoline-3-carboxylate Openeye Name: ethyl 6-bromoisoquinoline-3-carboxylate CAS Name: 6-bromo-3-isoquinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-bromoisoquinoline-3-carboxylate Traditional Name: 6-bromoisoquinoline-3-carboxylic acid ethyl ester Formula: C12H10BrNO2 MolecularWeight: 280.1173

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC=C2C=CC(=CC2=C1)Br

Isomeric SMILES

CCOC(=O)C1=NC=C2C=CC(=CC2=C1)Br

InChI

InChI=1S/C12H10BrNO2/c1-2-16-12(15)11-6-9-5-10(13)4-3-8(9)7-14-11/h3-7H,2H2,1H3