3-hexadecylbenzo[f]benzotriazole-4,9-dione

Systemtic Name: 3-hexadecylbenzo[f]benzotriazole-4,9-dione Openeye Name: 3-hexadecylbenzo[f]benzotriazole-4,9-dione CAS Name: 3-hexadecylbenzo[f]benzotriazole-4,9-dione IUPAC Name: 3-hexadecylbenzo[f]benzotriazole-4,9-dione Traditional Name: 3-cetylbenzo[f]benzotriazole-4,9-quinone Formula: C26H37N3O2 MolecularWeight: 423.59088

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCN1C2=C(C(=O)C3=CC=CC=C3C2=O)N=N1

Isomeric SMILES

CCCCCCCCCCCCCCCCN1C2=C(C(=O)C3=CC=CC=C3C2=O)N=N1

InChI

InChI=1S/C26H37N3O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-20-29-24-23(27-28-29)25(30)21-18-15-16-19-22(21)26(24)31/h15-16,18-19H,2-14,17,20H2,1H3