(3-bromanyl-4,5-dimethoxy-phenyl)-pyrrolidin-1-yl-methanone

Systemtic Name: (3-bromanyl-4,5-dimethoxy-phenyl)-pyrrolidin-1-yl-methanone Openeye Name: (3-bromo-4,5-dimethoxy-phenyl)-pyrrolidin-1-yl-methanone CAS Name: (3-bromo-4,5-dimethoxyphenyl)-(1-pyrrolidinyl)methanone IUPAC Name: (3-bromo-4,5-dimethoxyphenyl)-pyrrolidin-1-ylmethanone Traditional Name: (3-bromo-4,5-dimethoxy-phenyl)-pyrrolidino-methanone Formula: C13H16BrNO3 MolecularWeight: 314.17504

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C(=O)N2CCCC2)Br)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)C(=O)N2CCCC2)Br)OC

InChI

InChI=1S/C13H16BrNO3/c1-17-11-8-9(7-10(14)12(11)18-2)13(16)15-5-3-4-6-15/h7-8H,3-6H2,1-2H3