3-[4-(diphenylmethyl)piperazine-1,4-diium-1-yl]-1-(1H-indol-3-yl)propan-1-one

Systemtic Name: 3-[4-(diphenylmethyl)piperazine-1,4-diium-1-yl]-1-(1H-indol-3-yl)propan-1-one Openeye Name: 3-(4-benzhydrylpiperazine-1,4-diium-1-yl)-1-(1H-indol-3-yl)propan-1-one CAS Name: 3-[4-(diphenylmethyl)-1-piperazine-1,4-diiumyl]-1-(1H-indol-3-yl)-1-propanone IUPAC Name: 3-(4-benzhydrylpiperazine-1,4-diium-1-yl)-1-(1H-indol-3-yl)propan-1-one Traditional Name: 3-(4-benzhydrylpiperazine-1,4-diium-1-yl)-1-(1H-indol-3-yl)propan-1-one Formula: C28H31N3O+2 MolecularWeight: 425.56524

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CCC(=O)C2=CNC3=CC=CC=C32)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1C[NH+](CC[NH+]1CCC(=O)C2=CNC3=CC=CC=C32)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H29N3O/c32-27(25-21-29-26-14-8-7-13-24(25)26)15-16-30-17-19-31(20-18-30)28(22-9-3-1-4-10-22)23-11-5-2-6-12-23/h1-14,21,28-29H,15-20H2/p+2