3-[(R)-(4-methylpiperazine-1,4-diium-1-yl)-pyridin-2-yl-methyl]-1-oxidanyl-2-phenyl-indole

Systemtic Name: 3-[(R)-(4-methylpiperazine-1,4-diium-1-yl)-pyridin-2-yl-methyl]-1-oxidanyl-2-phenyl-indole Openeye Name: 1-hydroxy-3-[(R)-(4-methylpiperazine-1,4-diium-1-yl)-(2-pyridyl)methyl]-2-phenyl-indole CAS Name: 1-hydroxy-3-[(R)-(4-methyl-1-piperazine-1,4-diiumyl)-(2-pyridinyl)methyl]-2-phenylindole IUPAC Name: 1-hydroxy-3-[(R)-(4-methylpiperazine-1,4-diium-1-yl)-pyridin-2-ylmethyl]-2-phenylindole Traditional Name: 1-hydroxy-3-[(R)-(4-methylpiperazine-1,4-diium-1-yl)-(2-pyridyl)methyl]-2-phenyl-indole Formula: C25H28N4O+2 MolecularWeight: 400.51602

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)C(C2=CC=CC=N2)C3=C(N(C4=CC=CC=C43)O)C5=CC=CC=C5

Isomeric SMILES

C[NH+]1CC[NH+](CC1)[C@@H](C2=CC=CC=N2)C3=C(N(C4=CC=CC=C43)O)C5=CC=CC=C5

InChI

InChI=1S/C25H26N4O/c1-27-15-17-28(18-16-27)25(21-12-7-8-14-26-21)23-20-11-5-6-13-22(20)29(30)24(23)19-9-3-2-4-10-19/h2-14,25,30H,15-18H2,1H3/p+2/t25-/m0/s1