1-(2,3-dihydroindol-1-yl)-3-[4-(phenylmethyl)piperazin-4-ium-1-yl]propan-1-one

Systemtic Name: 1-(2,3-dihydroindol-1-yl)-3-[4-(phenylmethyl)piperazin-4-ium-1-yl]propan-1-one Openeye Name: 3-(4-benzylpiperazin-4-ium-1-yl)-1-indolin-1-yl-propan-1-one CAS Name: 1-(2,3-dihydroindol-1-yl)-3-[4-(phenylmethyl)-1-piperazin-4-iumyl]-1-propanone IUPAC Name: 3-(4-benzylpiperazin-4-ium-1-yl)-1-(2,3-dihydroindol-1-yl)propan-1-one Traditional Name: 3-(4-benzylpiperazin-4-ium-1-yl)-1-indolin-1-yl-propan-1-one Formula: C22H28N3O+ MolecularWeight: 350.47722

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C21)C(=O)CCN3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

C1CN(C2=CC=CC=C21)C(=O)CCN3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C22H27N3O/c26-22(25-13-10-20-8-4-5-9-21(20)25)11-12-23-14-16-24(17-15-23)18-19-6-2-1-3-7-19/h1-9H,10-18H2/p+1