2-methyl-3-[(R)-[4-(phenylmethyl)piperazine-1,4-diium-1-yl]-pyridin-2-yl-methyl]-1H-indole

Systemtic Name: 2-methyl-3-[(R)-[4-(phenylmethyl)piperazine-1,4-diium-1-yl]-pyridin-2-yl-methyl]-1H-indole Openeye Name: 3-[(R)-(4-benzylpiperazine-1,4-diium-1-yl)-(2-pyridyl)methyl]-2-methyl-1H-indole CAS Name: 2-methyl-3-[(R)-[4-(phenylmethyl)-1-piperazine-1,4-diiumyl]-(2-pyridinyl)methyl]-1H-indole IUPAC Name: 3-[(R)-(4-benzylpiperazine-1,4-diium-1-yl)-pyridin-2-ylmethyl]-2-methyl-1H-indole Traditional Name: 3-[(R)-(4-benzylpiperazine-1,4-diium-1-yl)-(2-pyridyl)methyl]-2-methyl-1H-indole Formula: C26H30N4+2 MolecularWeight: 398.5432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(C3=CC=CC=N3)[NH+]4CC[NH+](CC4)CC5=CC=CC=C5

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)[C@H](C3=CC=CC=N3)[NH+]4CC[NH+](CC4)CC5=CC=CC=C5

InChI

InChI=1S/C26H28N4/c1-20-25(22-11-5-6-12-23(22)28-20)26(24-13-7-8-14-27-24)30-17-15-29(16-18-30)19-21-9-3-2-4-10-21/h2-14,26,28H,15-19H2,1H3/p+2/t26-/m0/s1