1-[1,3-diphenyl-5-(phenylmethyl)pyrrolo[2,3-b]pyrazin-1-ium-6-yl]ethanone

Systemtic Name: 1-[1,3-diphenyl-5-(phenylmethyl)pyrrolo[2,3-b]pyrazin-1-ium-6-yl]ethanone Openeye Name: 1-(5-benzyl-1,3-diphenyl-pyrrolo[2,3-b]pyrazin-1-ium-6-yl)ethanone CAS Name: 1-[1,3-diphenyl-5-(phenylmethyl)-6-pyrrolo[2,3-b]pyrazin-1-iumyl]ethanone IUPAC Name: 1-(5-benzyl-1,3-diphenylpyrrolo[2,3-b]pyrazin-1-ium-6-yl)ethanone Traditional Name: 1-(5-benzyl-1,3-diphenyl-pyrrolo[2,3-b]pyrazin-1-ium-6-yl)ethanone Formula: C27H22N3O+ MolecularWeight: 404.48308

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=[N+](C=C(N=C2N1CC3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC(=O)C1=CC2=[N+](C=C(N=C2N1CC3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H22N3O/c1-20(31)25-17-26-27(30(25)18-21-11-5-2-6-12-21)28-24(22-13-7-3-8-14-22)19-29(26)23-15-9-4-10-16-23/h2-17,19H,18H2,1H3/q+1