N-[4-[(4-oxidanylidene-6-tridecanoyl-1,2,3-benzotriazin-3-yl)sulfonyl]phenyl]ethanamide

Systemtic Name: N-[4-[(4-oxidanylidene-6-tridecanoyl-1,2,3-benzotriazin-3-yl)sulfonyl]phenyl]ethanamide Openeye Name: N-[4-[(4-oxo-6-tridecanoyl-1,2,3-benzotriazin-3-yl)sulfonyl]phenyl]acetamide CAS Name: N-[4-[[4-oxo-6-(1-oxotridecyl)-1,2,3-benzotriazin-3-yl]sulfonyl]phenyl]acetamide IUPAC Name: N-[4-[(4-oxo-6-tridecanoyl-1,2,3-benzotriazin-3-yl)sulfonyl]phenyl]acetamide Traditional Name: N-[4-[(4-keto-6-tridecanoyl-1,2,3-benzotriazin-3-yl)sulfonyl]phenyl]acetamide Formula: C28H36N4O5S MolecularWeight: 540.67424

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(=O)C1=CC2=C(C=C1)N=NN(C2=O)S(=O)(=O)C3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CCCCCCCCCCCCC(=O)C1=CC2=C(C=C1)N=NN(C2=O)S(=O)(=O)C3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C28H36N4O5S/c1-3-4-5-6-7-8-9-10-11-12-13-27(34)22-14-19-26-25(20-22)28(35)32(31-30-26)38(36,37)24-17-15-23(16-18-24)29-21(2)33/h14-20H,3-13H2,1-2H3,(H,29,33)