4-methyl-3,5-dinitro-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: 4-methyl-3,5-dinitro-N-(phenylmethyl)benzenesulfonamide Openeye Name: N-benzyl-4-methyl-3,5-dinitro-benzenesulfonamide CAS Name: 4-methyl-3,5-dinitro-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-4-methyl-3,5-dinitrobenzenesulfonamide Traditional Name: N-benzyl-4-methyl-3,5-dinitro-benzenesulfonamide Formula: C14H13N3O6S MolecularWeight: 351.33452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)NCC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)NCC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H13N3O6S/c1-10-13(16(18)19)7-12(8-14(10)17(20)21)24(22,23)15-9-11-5-3-2-4-6-11/h2-8,15H,9H2,1H3