methyl (1S,2R)-2-[(2S)-1-(4-bromophenyl)-1-oxidanylidene-propan-2-yl]cyclopentane-1-carboxylate

Systemtic Name: methyl (1S,2R)-2-[(2S)-1-(4-bromophenyl)-1-oxidanylidene-propan-2-yl]cyclopentane-1-carboxylate Openeye Name: methyl (1S,2R)-2-[(1S)-2-(4-bromophenyl)-1-methyl-2-oxo-ethyl]cyclopentanecarboxylate CAS Name: (1S,2R)-2-[(2S)-1-(4-bromophenyl)-1-oxopropan-2-yl]-1-cyclopentanecarboxylic acid methyl ester IUPAC Name: methyl (1S,2R)-2-[(2S)-1-(4-bromophenyl)-1-oxopropan-2-yl]cyclopentane-1-carboxylate Traditional Name: (1S,2R)-2-[(1S)-2-(4-bromophenyl)-2-keto-1-methyl-ethyl]cyclopentanecarboxylic acid methyl ester Formula: C16H19BrO3 MolecularWeight: 339.22426

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCCC1C(=O)OC)C(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

C[C@@H]([C@H]1CCC[C@@H]1C(=O)OC)C(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C16H19BrO3/c1-10(13-4-3-5-14(13)16(19)20-2)15(18)11-6-8-12(17)9-7-11/h6-10,13-14H,3-5H2,1-2H3/t10-,13+,14-/m0/s1