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

Systemtic Name: 1-[6-bromanyl-1-(4-methoxyphenyl)-2-methyl-5-oxidanyl-4-(pyrrolidin-1-ylmethyl)indol-3-yl]ethanone Openeye Name: 1-[6-bromo-5-hydroxy-1-(4-methoxyphenyl)-2-methyl-4-(pyrrolidin-1-ylmethyl)indol-3-yl]ethanone CAS Name: 1-[6-bromo-5-hydroxy-1-(4-methoxyphenyl)-2-methyl-4-(1-pyrrolidinylmethyl)-3-indolyl]ethanone IUPAC Name: 1-[6-bromo-5-hydroxy-1-(4-methoxyphenyl)-2-methyl-4-(pyrrolidin-1-ylmethyl)indol-3-yl]ethanone Traditional Name: 1-[6-bromo-5-hydroxy-1-(4-methoxyphenyl)-2-methyl-4-(pyrrolidinomethyl)indol-3-yl]ethanone Formula: C23H25BrN2O3 MolecularWeight: 457.3602

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H25BrN2O3/c1-14-21(15(2)27)22-18(13-25-10-4-5-11-25)23(28)19(24)12-20(22)26(14)16-6-8-17(29-3)9-7-16/h6-9,12,28H,4-5,10-11,13H2,1-3H3