4-[(4-ethylphenyl)methyl-methyl-amino]-N-methyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-[(4-ethylphenyl)methyl-methyl-amino]-N-methyl-3-nitro-benzenesulfonamide Openeye Name: 4-[(4-ethylphenyl)methyl-methyl-amino]-N-methyl-3-nitro-benzenesulfonamide CAS Name: 4-[(4-ethylphenyl)methyl-methylamino]-N-methyl-3-nitrobenzenesulfonamide IUPAC Name: 4-[(4-ethylphenyl)methyl-methylamino]-N-methyl-3-nitrobenzenesulfonamide Traditional Name: 4-[(4-ethylbenzyl)-methyl-amino]-N-methyl-3-nitro-benzenesulfonamide Formula: C17H21N3O4S MolecularWeight: 363.43134

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21N3O4S/c1-4-13-5-7-14(8-6-13)12-19(3)16-10-9-15(25(23,24)18-2)11-17(16)20(21)22/h5-11,18H,4,12H2,1-3H3