phenyl 1-(2-bromanylprop-2-enyl)-1H-isoquinoline-2-carboxylate

Systemtic Name: phenyl 1-(2-bromanylprop-2-enyl)-1H-isoquinoline-2-carboxylate Openeye Name: phenyl 1-(2-bromoallyl)-1H-isoquinoline-2-carboxylate CAS Name: 1-(2-bromoprop-2-enyl)-1H-isoquinoline-2-carboxylic acid phenyl ester IUPAC Name: phenyl 1-(2-bromoprop-2-enyl)-1H-isoquinoline-2-carboxylate Traditional Name: 1-(2-bromoallyl)-1H-isoquinoline-2-carboxylic acid phenyl ester Formula: C19H16BrNO2 MolecularWeight: 370.23984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=C(CC1C2=CC=CC=C2C=CN1C(=O)OC3=CC=CC=C3)Br

Isomeric SMILES

C=C(CC1C2=CC=CC=C2C=CN1C(=O)OC3=CC=CC=C3)Br

InChI

InChI=1S/C19H16BrNO2/c1-14(20)13-18-17-10-6-5-7-15(17)11-12-21(18)19(22)23-16-8-3-2-4-9-16/h2-12,18H,1,13H2