N-[3-(3-methoxyphenyl)propyl]-4-methyl-3-nitro-benzenesulfonamide

Systemtic Name: N-[3-(3-methoxyphenyl)propyl]-4-methyl-3-nitro-benzenesulfonamide Openeye Name: N-[3-(3-methoxyphenyl)propyl]-4-methyl-3-nitro-benzenesulfonamide CAS Name: N-[3-(3-methoxyphenyl)propyl]-4-methyl-3-nitrobenzenesulfonamide IUPAC Name: N-[3-(3-methoxyphenyl)propyl]-4-methyl-3-nitrobenzenesulfonamide Traditional Name: N-[3-(3-methoxyphenyl)propyl]-4-methyl-3-nitro-benzenesulfonamide Formula: C17H20N2O5S MolecularWeight: 364.4161

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCCCC2=CC(=CC=C2)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCCCC2=CC(=CC=C2)OC)[N+](=O)[O-]

InChI

InChI=1S/C17H20N2O5S/c1-13-8-9-16(12-17(13)19(20)21)25(22,23)18-10-4-6-14-5-3-7-15(11-14)24-2/h3,5,7-9,11-12,18H,4,6,10H2,1-2H3