2-[4-(diphenylmethyl)piperazine-1,4-diium-1-yl]-1-[(2R)-2-methyl-2,3-dihydroindol-1-yl]ethanone

Systemtic Name: 2-[4-(diphenylmethyl)piperazine-1,4-diium-1-yl]-1-[(2R)-2-methyl-2,3-dihydroindol-1-yl]ethanone Openeye Name: 2-(4-benzhydrylpiperazine-1,4-diium-1-yl)-1-[(2R)-2-methylindolin-1-yl]ethanone CAS Name: 2-[4-(diphenylmethyl)-1-piperazine-1,4-diiumyl]-1-[(2R)-2-methyl-2,3-dihydroindol-1-yl]ethanone IUPAC Name: 2-(4-benzhydrylpiperazine-1,4-diium-1-yl)-1-[(2R)-2-methyl-2,3-dihydroindol-1-yl]ethanone Traditional Name: 2-(4-benzhydrylpiperazine-1,4-diium-1-yl)-1-[(2R)-2-methylindolin-1-yl]ethanone Formula: C28H33N3O+2 MolecularWeight: 427.58112

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C(=O)C[NH+]3CC[NH+](CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C[C@@H]1CC2=CC=CC=C2N1C(=O)C[NH+]3CC[NH+](CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H31N3O/c1-22-20-25-14-8-9-15-26(25)31(22)27(32)21-29-16-18-30(19-17-29)28(23-10-4-2-5-11-23)24-12-6-3-7-13-24/h2-15,22,28H,16-21H2,1H3/p+2/t22-/m1/s1