N-methyl-3-nitro-4-[[2-(phenoxymethyl)phenyl]methylamino]benzenesulfonamide

Systemtic Name: N-methyl-3-nitro-4-[[2-(phenoxymethyl)phenyl]methylamino]benzenesulfonamide Openeye Name: N-methyl-3-nitro-4-[[2-(phenoxymethyl)phenyl]methylamino]benzenesulfonamide CAS Name: N-methyl-3-nitro-4-[[2-(phenoxymethyl)phenyl]methylamino]benzenesulfonamide IUPAC Name: N-methyl-3-nitro-4-[[2-(phenoxymethyl)phenyl]methylamino]benzenesulfonamide Traditional Name: N-methyl-3-nitro-4-[[2-(phenoxymethyl)benzyl]amino]benzenesulfonamide Formula: C21H21N3O5S MolecularWeight: 427.47354

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC(=C(C=C1)NCC2=CC=CC=C2COC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CNS(=O)(=O)C1=CC(=C(C=C1)NCC2=CC=CC=C2COC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H21N3O5S/c1-22-30(27,28)19-11-12-20(21(13-19)24(25)26)23-14-16-7-5-6-8-17(16)15-29-18-9-3-2-4-10-18/h2-13,22-23H,14-15H2,1H3