2-methyl-5-nitro-N-(3-phenylmethoxypropyl)benzenesulfonamide

Systemtic Name: 2-methyl-5-nitro-N-(3-phenylmethoxypropyl)benzenesulfonamide Openeye Name: N-(3-benzyloxypropyl)-2-methyl-5-nitro-benzenesulfonamide CAS Name: 2-methyl-5-nitro-N-(3-phenylmethoxypropyl)benzenesulfonamide IUPAC Name: 2-methyl-5-nitro-N-(3-phenylmethoxypropyl)benzenesulfonamide Traditional Name: N-(3-benzoxypropyl)-2-methyl-5-nitro-benzenesulfonamide Formula: C17H20N2O5S MolecularWeight: 364.4161

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCCCOCC2=CC=CC=C2

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCCCOCC2=CC=CC=C2

InChI

InChI=1S/C17H20N2O5S/c1-14-8-9-16(19(20)21)12-17(14)25(22,23)18-10-5-11-24-13-15-6-3-2-4-7-15/h2-4,6-9,12,18H,5,10-11,13H2,1H3