2-(2-phenylindol-1-yl)-1-[4-(pyridin-4-ylmethyl)piperazin-4-ium-1-yl]ethanone

Systemtic Name: 2-(2-phenylindol-1-yl)-1-[4-(pyridin-4-ylmethyl)piperazin-4-ium-1-yl]ethanone Openeye Name: 2-(2-phenylindol-1-yl)-1-[4-(4-pyridylmethyl)piperazin-4-ium-1-yl]ethanone CAS Name: 2-(2-phenyl-1-indolyl)-1-[4-(pyridin-4-ylmethyl)-1-piperazin-4-iumyl]ethanone IUPAC Name: 2-(2-phenylindol-1-yl)-1-[4-(pyridin-4-ylmethyl)piperazin-4-ium-1-yl]ethanone Traditional Name: 2-(2-phenylindol-1-yl)-1-[4-(4-pyridylmethyl)piperazin-4-ium-1-yl]ethanone Formula: C26H27N4O+ MolecularWeight: 411.51878

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=NC=C2)C(=O)CN3C4=CC=CC=C4C=C3C5=CC=CC=C5

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=NC=C2)C(=O)CN3C4=CC=CC=C4C=C3C5=CC=CC=C5

InChI

InChI=1S/C26H26N4O/c31-26(29-16-14-28(15-17-29)19-21-10-12-27-13-11-21)20-30-24-9-5-4-8-23(24)18-25(30)22-6-2-1-3-7-22/h1-13,18H,14-17,19-20H2/p+1