N,N-diethyl-4-[(2-methyl-3-nitro-phenyl)methoxy]-3-nitro-benzenesulfonamide

Systemtic Name: N,N-diethyl-4-[(2-methyl-3-nitro-phenyl)methoxy]-3-nitro-benzenesulfonamide Openeye Name: N,N-diethyl-4-[(2-methyl-3-nitro-phenyl)methoxy]-3-nitro-benzenesulfonamide CAS Name: N,N-diethyl-4-[(2-methyl-3-nitrophenyl)methoxy]-3-nitrobenzenesulfonamide IUPAC Name: N,N-diethyl-4-[(2-methyl-3-nitrophenyl)methoxy]-3-nitrobenzenesulfonamide Traditional Name: N,N-diethyl-4-(2-methyl-3-nitro-benzyl)oxy-3-nitro-benzenesulfonamide Formula: C18H21N3O7S MolecularWeight: 423.44024

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OCC2=C(C(=CC=C2)[N+](=O)[O-])C)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OCC2=C(C(=CC=C2)[N+](=O)[O-])C)[N+](=O)[O-]

InChI

InChI=1S/C18H21N3O7S/c1-4-19(5-2)29(26,27)15-9-10-18(17(11-15)21(24)25)28-12-14-7-6-8-16(13(14)3)20(22)23/h6-11H,4-5,12H2,1-3H3