octyl 2-(4-oxidanylidenebenzo[g][1,2,3]benzotriazin-3-yl)sulfonylbenzoate

Systemtic Name: octyl 2-(4-oxidanylidenebenzo[g][1,2,3]benzotriazin-3-yl)sulfonylbenzoate Openeye Name: octyl 2-(4-oxobenzo[g][1,2,3]benzotriazin-3-yl)sulfonylbenzoate CAS Name: 2-[(4-oxo-3-benzo[g][1,2,3]benzotriazinyl)sulfonyl]benzoic acid octyl ester IUPAC Name: octyl 2-(4-oxobenzo[g][1,2,3]benzotriazin-3-yl)sulfonylbenzoate Traditional Name: 2-(4-ketobenzo[g][1,2,3]benzotriazin-3-yl)sulfonylbenzoic acid octyl ester Formula: C26H27N3O5S MolecularWeight: 493.57468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C1=CC=CC=C1S(=O)(=O)N2C(=O)C3=CC4=CC=CC=C4C=C3N=N2

Isomeric SMILES

CCCCCCCCOC(=O)C1=CC=CC=C1S(=O)(=O)N2C(=O)C3=CC4=CC=CC=C4C=C3N=N2

InChI

InChI=1S/C26H27N3O5S/c1-2-3-4-5-6-11-16-34-26(31)21-14-9-10-15-24(21)35(32,33)29-25(30)22-17-19-12-7-8-13-20(19)18-23(22)27-28-29/h7-10,12-15,17-18H,2-6,11,16H2,1H3