N-(2-dimethylaminoethyl)-3-nitro-4-(2,3,5-trimethylphenoxy)benzenesulfonamide

Systemtic Name: N-(2-dimethylaminoethyl)-3-nitro-4-(2,3,5-trimethylphenoxy)benzenesulfonamide Openeye Name: N-(2-dimethylaminoethyl)-3-nitro-4-(2,3,5-trimethylphenoxy)benzenesulfonamide CAS Name: N-(2-dimethylaminoethyl)-3-nitro-4-(2,3,5-trimethylphenoxy)benzenesulfonamide IUPAC Name: N-(2-dimethylaminoethyl)-3-nitro-4-(2,3,5-trimethylphenoxy)benzenesulfonamide Traditional Name: N-(2-dimethylaminoethyl)-3-nitro-4-(2,3,5-trimethylphenoxy)benzenesulfonamide Formula: C19H25N3O5S MolecularWeight: 407.4839

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OC2=C(C=C(C=C2)S(=O)(=O)NCCN(C)C)[N+](=O)[O-])C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)OC2=C(C=C(C=C2)S(=O)(=O)NCCN(C)C)[N+](=O)[O-])C)C

InChI

InChI=1S/C19H25N3O5S/c1-13-10-14(2)15(3)19(11-13)27-18-7-6-16(12-17(18)22(23)24)28(25,26)20-8-9-21(4)5/h6-7,10-12,20H,8-9H2,1-5H3