(2R)-1-(1H-indol-3-yl)-2-(4-phenylpiperazine-1,4-diium-1-yl)propan-1-one

Systemtic Name: (2R)-1-(1H-indol-3-yl)-2-(4-phenylpiperazine-1,4-diium-1-yl)propan-1-one Openeye Name: (2R)-1-(1H-indol-3-yl)-2-(4-phenylpiperazine-1,4-diium-1-yl)propan-1-one CAS Name: (2R)-1-(1H-indol-3-yl)-2-(4-phenyl-1-piperazine-1,4-diiumyl)-1-propanone IUPAC Name: (2R)-1-(1H-indol-3-yl)-2-(4-phenylpiperazine-1,4-diium-1-yl)propan-1-one Traditional Name: (2R)-1-(1H-indol-3-yl)-2-(4-phenylpiperazine-1,4-diium-1-yl)propan-1-one Formula: C21H25N3O+2 MolecularWeight: 335.4427

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CNC2=CC=CC=C21)[NH+]3CC[NH+](CC3)C4=CC=CC=C4

Isomeric SMILES

C[C@H](C(=O)C1=CNC2=CC=CC=C21)[NH+]3CC[NH+](CC3)C4=CC=CC=C4

InChI

InChI=1S/C21H23N3O/c1-16(21(25)19-15-22-20-10-6-5-9-18(19)20)23-11-13-24(14-12-23)17-7-3-2-4-8-17/h2-10,15-16,22H,11-14H2,1H3/p+2/t16-/m1/s1