2-(6-bromanyl-3,4-dimethoxy-2-methyl-phenyl)-2-[(2S)-2-cyclohexa-1,3-dien-1-ylpropyl]-1,3-dioxolane

Systemtic Name: 2-(6-bromanyl-3,4-dimethoxy-2-methyl-phenyl)-2-[(2S)-2-cyclohexa-1,3-dien-1-ylpropyl]-1,3-dioxolane Openeye Name: 2-(6-bromo-3,4-dimethoxy-2-methyl-phenyl)-2-[(2S)-2-cyclohexa-1,3-dien-1-ylpropyl]-1,3-dioxolane CAS Name: 2-(6-bromo-3,4-dimethoxy-2-methylphenyl)-2-[(2S)-2-(1-cyclohexa-1,3-dienyl)propyl]-1,3-dioxolane IUPAC Name: 2-(6-bromo-3,4-dimethoxy-2-methylphenyl)-2-[(2S)-2-cyclohexa-1,3-dien-1-ylpropyl]-1,3-dioxolane Traditional Name: 2-(6-bromo-3,4-dimethoxy-2-methyl-phenyl)-2-[(2S)-2-cyclohexa-1,3-dien-1-ylpropyl]-1,3-dioxolane Formula: C21H27BrO4 MolecularWeight: 423.34068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1C2(OCCO2)CC(C)C3=CC=CCC3)Br)OC)OC

Isomeric SMILES

CC1=C(C(=CC(=C1C2(OCCO2)C[C@H](C)C3=CC=CCC3)Br)OC)OC

InChI

InChI=1S/C21H27BrO4/c1-14(16-8-6-5-7-9-16)13-21(25-10-11-26-21)19-15(2)20(24-4)18(23-3)12-17(19)22/h5-6,8,12,14H,7,9-11,13H2,1-4H3/t14-/m0/s1