2-(benzotriazol-1-yl)-3-[(4-phenylphenyl)amino]naphthalene-1,4-dione

Systemtic Name: 2-(benzotriazol-1-yl)-3-[(4-phenylphenyl)amino]naphthalene-1,4-dione Openeye Name: 2-(benzotriazol-1-yl)-3-(4-phenylanilino)naphthalene-1,4-dione CAS Name: 2-(1-benzotriazolyl)-3-(4-phenylanilino)naphthalene-1,4-dione IUPAC Name: 2-(benzotriazol-1-yl)-3-(4-phenylanilino)naphthalene-1,4-dione Traditional Name: 2-(benzotriazol-1-yl)-3-(4-phenylanilino)-1,4-naphthoquinone Formula: C28H18N4O2 MolecularWeight: 442.46812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)NC3=C(C(=O)C4=CC=CC=C4C3=O)N5C6=CC=CC=C6N=N5

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)NC3=C(C(=O)C4=CC=CC=C4C3=O)N5C6=CC=CC=C6N=N5

InChI

InChI=1S/C28H18N4O2/c33-27-21-10-4-5-11-22(21)28(34)26(32-24-13-7-6-12-23(24)30-31-32)25(27)29-20-16-14-19(15-17-20)18-8-2-1-3-9-18/h1-17,29H