1-(3-azabicyclo[2.2.2]octan-3-yl)-2-[2-(3,5-dimethylphenyl)-3-[(2S)-1-(2-morpholin-4-ylethylamino)propan-2-yl]-1H-indol-5-yl]-2-methyl-propan-1-one

Systemtic Name: 1-(3-azabicyclo[2.2.2]octan-3-yl)-2-[2-(3,5-dimethylphenyl)-3-[(2S)-1-(2-morpholin-4-ylethylamino)propan-2-yl]-1H-indol-5-yl]-2-methyl-propan-1-one Openeye Name: 1-(3-azabicyclo[2.2.2]octan-3-yl)-2-[2-(3,5-dimethylphenyl)-3-[(1S)-1-methyl-2-(2-morpholinoethylamino)ethyl]-1H-indol-5-yl]-2-methyl-propan-1-one CAS Name: 1-(3-azabicyclo[2.2.2]octan-3-yl)-2-[2-(3,5-dimethylphenyl)-3-[(2S)-1-[2-(4-morpholinyl)ethylamino]propan-2-yl]-1H-indol-5-yl]-2-methyl-1-propanone IUPAC Name: 1-(3-azabicyclo[2.2.2]octan-3-yl)-2-[2-(3,5-dimethylphenyl)-3-[(2S)-1-(2-morpholin-4-ylethylamino)propan-2-yl]-1H-indol-5-yl]-2-methylpropan-1-one Traditional Name: 1-(3-azabicyclo[2.2.2]octan-3-yl)-2-[2-(3,5-dimethylphenyl)-3-[(1S)-1-methyl-2-(2-morpholinoethylamino)ethyl]-1H-indol-5-yl]-2-methyl-propan-1-one Formula: C36H50N4O2 MolecularWeight: 570.8078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C2=C(C3=C(N2)C=CC(=C3)C(C)(C)C(=O)N4CC5CCC4CC5)C(C)CNCCN6CCOCC6)C

Isomeric SMILES

CC1=CC(=CC(=C1)C2=C(C3=C(N2)C=CC(=C3)C(C)(C)C(=O)N4CC5CCC4CC5)[C@H](C)CNCCN6CCOCC6)C

InChI

InChI=1S/C36H50N4O2/c1-24-18-25(2)20-28(19-24)34-33(26(3)22-37-12-13-39-14-16-42-17-15-39)31-21-29(8-11-32(31)38-34)36(4,5)35(41)40-23-27-6-9-30(40)10-7-27/h8,11,18-21,26-27,30,37-38H,6-7,9-10,12-17,22-23H2,1-5H3/t26-,27?,30?/m1/s1