N-[2-(3-chlorophenyl)ethyl]-4-methyl-3-nitro-benzenesulfonamide

Systemtic Name: N-[2-(3-chlorophenyl)ethyl]-4-methyl-3-nitro-benzenesulfonamide Openeye Name: N-[2-(3-chlorophenyl)ethyl]-4-methyl-3-nitro-benzenesulfonamide CAS Name: N-[2-(3-chlorophenyl)ethyl]-4-methyl-3-nitrobenzenesulfonamide IUPAC Name: N-[2-(3-chlorophenyl)ethyl]-4-methyl-3-nitrobenzenesulfonamide Traditional Name: N-[2-(3-chlorophenyl)ethyl]-4-methyl-3-nitro-benzenesulfonamide Formula: C15H15ClN2O4S MolecularWeight: 354.8086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCCC2=CC(=CC=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCCC2=CC(=CC=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C15H15ClN2O4S/c1-11-5-6-14(10-15(11)18(19)20)23(21,22)17-8-7-12-3-2-4-13(16)9-12/h2-6,9-10,17H,7-8H2,1H3