(phenylmethyl) 5-bromanyl-1-methyl-1,3-dihydroisoindole-2-carboxylate

Systemtic Name: (phenylmethyl) 5-bromanyl-1-methyl-1,3-dihydroisoindole-2-carboxylate Openeye Name: benzyl 5-bromo-1-methyl-isoindoline-2-carboxylate CAS Name: 5-bromo-1-methyl-1,3-dihydroisoindole-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 5-bromo-1-methyl-1,3-dihydroisoindole-2-carboxylate Traditional Name: 5-bromo-1-methyl-isoindoline-2-carboxylic acid benzyl ester Formula: C17H16BrNO2 MolecularWeight: 346.21844

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=C(CN1C(=O)OCC3=CC=CC=C3)C=C(C=C2)Br

Isomeric SMILES

CC1C2=C(CN1C(=O)OCC3=CC=CC=C3)C=C(C=C2)Br

InChI

InChI=1S/C17H16BrNO2/c1-12-16-8-7-15(18)9-14(16)10-19(12)17(20)21-11-13-5-3-2-4-6-13/h2-9,12H,10-11H2,1H3