2-(2H-benzotriazol-1-ium-1-yl)-5-(benzotriazol-1-yl)-3,6-di(piperidin-1-yl)cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 2-(2H-benzotriazol-1-ium-1-yl)-5-(benzotriazol-1-yl)-3,6-di(piperidin-1-yl)cyclohexa-2,5-diene-1,4-dione Openeye Name: 2-(2H-benzotriazol-1-ium-1-yl)-5-(benzotriazol-1-yl)-3,6-bis(1-piperidyl)-1,4-benzoquinone CAS Name: 2-(2H-benzotriazol-1-ium-1-yl)-5-(1-benzotriazolyl)-3,6-bis(1-piperidinyl)cyclohexa-2,5-diene-1,4-dione IUPAC Name: 2-(2H-benzotriazol-1-ium-1-yl)-5-(benzotriazol-1-yl)-3,6-di(piperidin-1-yl)cyclohexa-2,5-diene-1,4-dione Traditional Name: 2-(2H-benzotriazol-1-ium-1-yl)-5-(benzotriazol-1-yl)-3,6-dipiperidino-p-benzoquinone Formula: C28H29N8O2+ MolecularWeight: 509.58226

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C(=O)C(=C(C2=O)[N+]3=C4C=CC=CC4=NN3)N5CCCCC5)N6C7=CC=CC=C7N=N6

Isomeric SMILES

C1CCN(CC1)C2=C(C(=O)C(=C(C2=O)[N+]3=C4C=CC=CC4=NN3)N5CCCCC5)N6C7=CC=CC=C7N=N6

InChI

InChI=1S/C28H28N8O2/c37-27-23(33-15-7-1-8-16-33)25(35-21-13-5-3-11-19(21)29-31-35)28(38)24(34-17-9-2-10-18-34)26(27)36-22-14-6-4-12-20(22)30-32-36/h3-6,11-14H,1-2,7-10,15-18H2/p+1