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

Systemtic Name: 2,5-bis(benzotriazol-1-yl)-3,6-bis[(4-bromophenyl)amino]cyclohexa-2,5-diene-1,4-dione Openeye Name: 2,5-bis(benzotriazol-1-yl)-3,6-bis(4-bromoanilino)-1,4-benzoquinone CAS Name: 2,5-bis(1-benzotriazolyl)-3,6-bis(4-bromoanilino)cyclohexa-2,5-diene-1,4-dione IUPAC Name: 2,5-bis(benzotriazol-1-yl)-3,6-bis(4-bromoanilino)cyclohexa-2,5-diene-1,4-dione Traditional Name: 2,5-bis(benzotriazol-1-yl)-3,6-bis(4-bromoanilino)-p-benzoquinone Formula: C30H18Br2N8O2 MolecularWeight: 682.32432

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2C3=C(C(=O)C(=C(C3=O)NC4=CC=C(C=C4)Br)N5C6=CC=CC=C6N=N5)NC7=CC=C(C=C7)Br

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2C3=C(C(=O)C(=C(C3=O)NC4=CC=C(C=C4)Br)N5C6=CC=CC=C6N=N5)NC7=CC=C(C=C7)Br

InChI

InChI=1S/C30H18Br2N8O2/c31-17-9-13-19(14-10-17)33-25-27(39-23-7-3-1-5-21(23)35-37-39)29(41)26(34-20-15-11-18(32)12-16-20)28(30(25)42)40-24-8-4-2-6-22(24)36-38-40/h1-16,33-34H