1-[7-bromanyl-1-(3,4-dimethoxyphenyl)heptyl]sulfanyl-2,3-dimethoxy-benzene

Systemtic Name: 1-[7-bromanyl-1-(3,4-dimethoxyphenyl)heptyl]sulfanyl-2,3-dimethoxy-benzene Openeye Name: 1-[7-bromo-1-(3,4-dimethoxyphenyl)heptyl]sulfanyl-2,3-dimethoxy-benzene CAS Name: 1-[[7-bromo-1-(3,4-dimethoxyphenyl)heptyl]thio]-2,3-dimethoxybenzene IUPAC Name: 1-[7-bromo-1-(3,4-dimethoxyphenyl)heptyl]sulfanyl-2,3-dimethoxybenzene Traditional Name: 1-[[7-bromo-1-(3,4-dimethoxyphenyl)heptyl]thio]-2,3-dimethoxy-benzene Formula: C23H31BrO4S MolecularWeight: 483.45884

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)SC(CCCCCCBr)C2=CC(=C(C=C2)OC)OC)OC

Isomeric SMILES

COC1=C(C(=CC=C1)SC(CCCCCCBr)C2=CC(=C(C=C2)OC)OC)OC

InChI

InChI=1S/C23H31BrO4S/c1-25-18-14-13-17(16-20(18)27-3)21(11-7-5-6-8-15-24)29-22-12-9-10-19(26-2)23(22)28-4/h9-10,12-14,16,21H,5-8,11,15H2,1-4H3