2,5-bis(benzotriazol-1-yl)-3,6-bis[(3-methylphenyl)amino]cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 2,5-bis(benzotriazol-1-yl)-3,6-bis[(3-methylphenyl)amino]cyclohexa-2,5-diene-1,4-dione Openeye Name: 2,5-bis(benzotriazol-1-yl)-3,6-bis(3-methylanilino)-1,4-benzoquinone CAS Name: 2,5-bis(1-benzotriazolyl)-3,6-bis(3-methylanilino)cyclohexa-2,5-diene-1,4-dione IUPAC Name: 2,5-bis(benzotriazol-1-yl)-3,6-bis(3-methylanilino)cyclohexa-2,5-diene-1,4-dione Traditional Name: 2,5-bis(benzotriazol-1-yl)-3,6-bis(m-toluidino)-p-benzoquinone Formula: C32H24N8O2 MolecularWeight: 552.58536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=C(C(=O)C(=C(C2=O)N3C4=CC=CC=C4N=N3)NC5=CC=CC(=C5)C)N6C7=CC=CC=C7N=N6

Isomeric SMILES

CC1=CC(=CC=C1)NC2=C(C(=O)C(=C(C2=O)N3C4=CC=CC=C4N=N3)NC5=CC=CC(=C5)C)N6C7=CC=CC=C7N=N6

InChI

InChI=1S/C32H24N8O2/c1-19-9-7-11-21(17-19)33-27-29(39-25-15-5-3-13-23(25)35-37-39)32(42)28(34-22-12-8-10-20(2)18-22)30(31(27)41)40-26-16-6-4-14-24(26)36-38-40/h3-18,33-34H,1-2H3