N-[(E)-[1-(benzotriazol-1-yl)-1-phenoxy-nonan-2-ylidene]amino]-4-methyl-benzenesulfonamide

Systemtic Name: N-[(E)-[1-(benzotriazol-1-yl)-1-phenoxy-nonan-2-ylidene]amino]-4-methyl-benzenesulfonamide Openeye Name: N-[(E)-1-[benzotriazol-1-yl(phenoxy)methyl]octylideneamino]-4-methyl-benzenesulfonamide CAS Name: N-[(E)-[1-(1-benzotriazolyl)-1-phenoxynonan-2-ylidene]amino]-4-methylbenzenesulfonamide IUPAC Name: N-[(E)-[1-(benzotriazol-1-yl)-1-phenoxynonan-2-ylidene]amino]-4-methylbenzenesulfonamide Traditional Name: N-[(E)-1-[benzotriazol-1-yl(phenoxy)methyl]octylideneamino]-4-methyl-benzenesulfonamide Formula: C28H33N5O3S MolecularWeight: 519.65832

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=NNS(=O)(=O)C1=CC=C(C=C1)C)C(N2C3=CC=CC=C3N=N2)OC4=CC=CC=C4

Isomeric SMILES

CCCCCCC/C(=N\NS(=O)(=O)C1=CC=C(C=C1)C)/C(N2C3=CC=CC=C3N=N2)OC4=CC=CC=C4

InChI

InChI=1S/C28H33N5O3S/c1-3-4-5-6-10-16-26(30-32-37(34,35)24-20-18-22(2)19-21-24)28(36-23-13-8-7-9-14-23)33-27-17-12-11-15-25(27)29-31-33/h7-9,11-15,17-21,28,32H,3-6,10,16H2,1-2H3/b30-26+