1-(4-chloranyl-3-pentoxy-phenyl)sulfonylbenzotriazole

Systemtic Name: 1-(4-chloranyl-3-pentoxy-phenyl)sulfonylbenzotriazole Openeye Name: 1-(4-chloro-3-pentoxy-phenyl)sulfonylbenzotriazole CAS Name: 1-(4-chloro-3-pentoxyphenyl)sulfonylbenzotriazole IUPAC Name: 1-(4-chloro-3-pentoxyphenyl)sulfonylbenzotriazole Traditional Name: 1-(3-amoxy-4-chloro-phenyl)sulfonylbenzotriazole Formula: C17H18ClN3O3S MolecularWeight: 379.86112

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=CC(=C1)S(=O)(=O)N2C3=CC=CC=C3N=N2)Cl

Isomeric SMILES

CCCCCOC1=C(C=CC(=C1)S(=O)(=O)N2C3=CC=CC=C3N=N2)Cl

InChI

InChI=1S/C17H18ClN3O3S/c1-2-3-6-11-24-17-12-13(9-10-14(17)18)25(22,23)21-16-8-5-4-7-15(16)19-20-21/h4-5,7-10,12H,2-3,6,11H2,1H3