1-(2-bromophenyl)-4-(5,5-dimethyl-1,3-dioxan-2-yl)butan-1-one

Systemtic Name: 1-(2-bromophenyl)-4-(5,5-dimethyl-1,3-dioxan-2-yl)butan-1-one Openeye Name: 1-(2-bromophenyl)-4-(5,5-dimethyl-1,3-dioxan-2-yl)butan-1-one CAS Name: 1-(2-bromophenyl)-4-(5,5-dimethyl-1,3-dioxan-2-yl)-1-butanone IUPAC Name: 1-(2-bromophenyl)-4-(5,5-dimethyl-1,3-dioxan-2-yl)butan-1-one Traditional Name: 1-(2-bromophenyl)-4-(5,5-dimethyl-1,3-dioxan-2-yl)butan-1-one Formula: C16H21BrO3 MolecularWeight: 341.24014

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC(OC1)CCCC(=O)C2=CC=CC=C2Br)C

Isomeric SMILES

CC1(COC(OC1)CCCC(=O)C2=CC=CC=C2Br)C

InChI

InChI=1S/C16H21BrO3/c1-16(2)10-19-15(20-11-16)9-5-8-14(18)12-6-3-4-7-13(12)17/h3-4,6-7,15H,5,8-11H2,1-2H3