6-(2-bromoethyl)-5,7-bis(deuteriomethyl)-2-methyl-2,3-dihydroinden-1-one

Systemtic Name: 6-(2-bromoethyl)-5,7-bis(deuteriomethyl)-2-methyl-2,3-dihydroinden-1-one Openeye Name: 6-(2-bromoethyl)-5,7-bis(deuteriomethyl)-2-methyl-indan-1-one CAS Name: 6-(2-bromoethyl)-5,7-bis(deuteriomethyl)-2-methyl-2,3-dihydroinden-1-one IUPAC Name: 6-(2-bromoethyl)-5,7-bis(deuteriomethyl)-2-methyl-2,3-dihydroinden-1-one Traditional Name: 6-(2-bromoethyl)-5,7-bis(deuteriomethyl)-2-methyl-indan-1-one Formula: C14H17BrO MolecularWeight: 283.200504

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC(=C(C(=C2C1=O)C)CCBr)C

Isomeric SMILES

[2H]CC1=C(C(=C2C(=C1)CC(C2=O)C)C[2H])CCBr

InChI

InChI=1S/C14H17BrO/c1-8-6-11-7-9(2)14(16)13(11)10(3)12(8)4-5-15/h6,9H,4-5,7H2,1-3H3/i1D,3D