N-[3-(benzotriazol-1-yl)-2-oxidanyl-propyl]-N-(2-methoxy-5-nitro-phenyl)-4-methyl-benzenesulfonamide

Systemtic Name: N-[3-(benzotriazol-1-yl)-2-oxidanyl-propyl]-N-(2-methoxy-5-nitro-phenyl)-4-methyl-benzenesulfonamide Openeye Name: N-[3-(benzotriazol-1-yl)-2-hydroxy-propyl]-N-(2-methoxy-5-nitro-phenyl)-4-methyl-benzenesulfonamide CAS Name: N-[3-(1-benzotriazolyl)-2-hydroxypropyl]-N-(2-methoxy-5-nitrophenyl)-4-methylbenzenesulfonamide IUPAC Name: N-[3-(benzotriazol-1-yl)-2-hydroxypropyl]-N-(2-methoxy-5-nitrophenyl)-4-methylbenzenesulfonamide Traditional Name: N-[3-(benzotriazol-1-yl)-2-hydroxy-propyl]-N-(2-methoxy-5-nitro-phenyl)-4-methyl-benzenesulfonamide Formula: C23H23N5O6S MolecularWeight: 497.52362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(CN2C3=CC=CC=C3N=N2)O)C4=C(C=CC(=C4)[N+](=O)[O-])OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(CN2C3=CC=CC=C3N=N2)O)C4=C(C=CC(=C4)[N+](=O)[O-])OC

InChI

InChI=1S/C23H23N5O6S/c1-16-7-10-19(11-8-16)35(32,33)27(22-13-17(28(30)31)9-12-23(22)34-2)15-18(29)14-26-21-6-4-3-5-20(21)24-25-26/h3-13,18,29H,14-15H2,1-2H3