1-[6-bromanyl-2-methyl-5-oxidanyl-1-phenyl-4-(pyrrolidin-1-ylmethyl)indol-3-yl]ethanone

Systemtic Name: 1-[6-bromanyl-2-methyl-5-oxidanyl-1-phenyl-4-(pyrrolidin-1-ylmethyl)indol-3-yl]ethanone Openeye Name: 1-[6-bromo-5-hydroxy-2-methyl-1-phenyl-4-(pyrrolidin-1-ylmethyl)indol-3-yl]ethanone CAS Name: 1-[6-bromo-5-hydroxy-2-methyl-1-phenyl-4-(1-pyrrolidinylmethyl)-3-indolyl]ethanone IUPAC Name: 1-[6-bromo-5-hydroxy-2-methyl-1-phenyl-4-(pyrrolidin-1-ylmethyl)indol-3-yl]ethanone Traditional Name: 1-[6-bromo-5-hydroxy-2-methyl-1-phenyl-4-(pyrrolidinomethyl)indol-3-yl]ethanone Formula: C22H23BrN2O2 MolecularWeight: 427.33422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C(=C(C=C2N1C3=CC=CC=C3)Br)O)CN4CCCC4)C(=O)C

Isomeric SMILES

CC1=C(C2=C(C(=C(C=C2N1C3=CC=CC=C3)Br)O)CN4CCCC4)C(=O)C

InChI

InChI=1S/C22H23BrN2O2/c1-14-20(15(2)26)21-17(13-24-10-6-7-11-24)22(27)18(23)12-19(21)25(14)16-8-4-3-5-9-16/h3-5,8-9,12,27H,6-7,10-11,13H2,1-2H3