2-phenyl-3-[(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)methyl]-1H-indole

Systemtic Name: 2-phenyl-3-[(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)methyl]-1H-indole Openeye Name: 2-phenyl-3-[(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)methyl]-1H-indole CAS Name: 2-phenyl-3-[[4-(2-pyrimidinyl)-1-piperazin-1-iumyl]methyl]-1H-indole IUPAC Name: 2-phenyl-3-[(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)methyl]-1H-indole Traditional Name: 2-phenyl-3-[[4-(2-pyrimidyl)piperazin-1-ium-1-yl]methyl]-1H-indole Formula: C23H24N5+ MolecularWeight: 370.47016

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=C(NC3=CC=CC=C32)C4=CC=CC=C4)C5=NC=CC=N5

Isomeric SMILES

C1CN(CC[NH+]1CC2=C(NC3=CC=CC=C32)C4=CC=CC=C4)C5=NC=CC=N5

InChI

InChI=1S/C23H23N5/c1-2-7-18(8-3-1)22-20(19-9-4-5-10-21(19)26-22)17-27-13-15-28(16-14-27)23-24-11-6-12-25-23/h1-12,26H,13-17H2/p+1