2-(2-bromanyl-4,5-dimethoxy-phenyl)-1-[(2S)-2-thiophen-2-ylpyrrolidin-1-yl]ethanone

Systemtic Name: 2-(2-bromanyl-4,5-dimethoxy-phenyl)-1-[(2S)-2-thiophen-2-ylpyrrolidin-1-yl]ethanone Openeye Name: 2-(2-bromo-4,5-dimethoxy-phenyl)-1-[(2S)-2-(2-thienyl)pyrrolidin-1-yl]ethanone CAS Name: 2-(2-bromo-4,5-dimethoxyphenyl)-1-[(2S)-2-thiophen-2-yl-1-pyrrolidinyl]ethanone IUPAC Name: 2-(2-bromo-4,5-dimethoxyphenyl)-1-[(2S)-2-thiophen-2-ylpyrrolidin-1-yl]ethanone Traditional Name: 2-(2-bromo-4,5-dimethoxy-phenyl)-1-[(2S)-2-(2-thienyl)pyrrolidino]ethanone Formula: C18H20BrNO3S MolecularWeight: 410.3253

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CC(=O)N2CCCC2C3=CC=CS3)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CC(=O)N2CCC[C@H]2C3=CC=CS3)Br)OC

InChI

InChI=1S/C18H20BrNO3S/c1-22-15-9-12(13(19)11-16(15)23-2)10-18(21)20-7-3-5-14(20)17-6-4-8-24-17/h4,6,8-9,11,14H,3,5,7,10H2,1-2H3/t14-/m0/s1