N-[(4-ethylphenyl)methyl]-N-methyl-4-nitro-benzenesulfonamide

Systemtic Name: N-[(4-ethylphenyl)methyl]-N-methyl-4-nitro-benzenesulfonamide Openeye Name: N-[(4-ethylphenyl)methyl]-N-methyl-4-nitro-benzenesulfonamide CAS Name: N-[(4-ethylphenyl)methyl]-N-methyl-4-nitrobenzenesulfonamide IUPAC Name: N-[(4-ethylphenyl)methyl]-N-methyl-4-nitrobenzenesulfonamide Traditional Name: N-(4-ethylbenzyl)-N-methyl-4-nitro-benzenesulfonamide Formula: C16H18N2O4S MolecularWeight: 334.39012

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN(C)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)CN(C)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H18N2O4S/c1-3-13-4-6-14(7-5-13)12-17(2)23(21,22)16-10-8-15(9-11-16)18(19)20/h4-11H,3,12H2,1-2H3