(2S,3R,6S)-2-[(2-bromophenyl)methyl]-3-methyl-6-propan-2-yl-cyclohexan-1-one

Systemtic Name: (2S,3R,6S)-2-[(2-bromophenyl)methyl]-3-methyl-6-propan-2-yl-cyclohexan-1-one Openeye Name: (2S,3R,6S)-2-[(2-bromophenyl)methyl]-6-isopropyl-3-methyl-cyclohexanone CAS Name: (2S,3R,6S)-2-[(2-bromophenyl)methyl]-3-methyl-6-propan-2-yl-1-cyclohexanone IUPAC Name: (2S,3R,6S)-2-[(2-bromophenyl)methyl]-3-methyl-6-propan-2-ylcyclohexan-1-one Traditional Name: (2S,3R,6S)-2-(2-bromobenzyl)-6-isopropyl-3-methyl-cyclohexanone Formula: C17H23BrO MolecularWeight: 323.26792

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(=O)C1CC2=CC=CC=C2Br)C(C)C

Isomeric SMILES

C[C@@H]1CC[C@H](C(=O)[C@H]1CC2=CC=CC=C2Br)C(C)C

InChI

InChI=1S/C17H23BrO/c1-11(2)14-9-8-12(3)15(17(14)19)10-13-6-4-5-7-16(13)18/h4-7,11-12,14-15H,8-10H2,1-3H3/t12-,14+,15+/m1/s1