N-(2-diethylaminoethyl)-N-(5-methoxy-4-methyl-2-nitro-phenyl)-4-methyl-benzenesulfonamide

Systemtic Name: N-(2-diethylaminoethyl)-N-(5-methoxy-4-methyl-2-nitro-phenyl)-4-methyl-benzenesulfonamide Openeye Name: N-(2-diethylaminoethyl)-N-(5-methoxy-4-methyl-2-nitro-phenyl)-4-methyl-benzenesulfonamide CAS Name: N-(2-diethylaminoethyl)-N-(5-methoxy-4-methyl-2-nitrophenyl)-4-methylbenzenesulfonamide IUPAC Name: N-(2-diethylaminoethyl)-N-(5-methoxy-4-methyl-2-nitrophenyl)-4-methylbenzenesulfonamide Traditional Name: N-(2-diethylaminoethyl)-N-(5-methoxy-4-methyl-2-nitro-phenyl)-4-methyl-benzenesulfonamide Formula: C21H29N3O5S MolecularWeight: 435.53706

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29N3O5S/c1-6-22(7-2)12-13-23(30(27,28)18-10-8-16(3)9-11-18)19-15-21(29-5)17(4)14-20(19)24(25)26/h8-11,14-15H,6-7,12-13H2,1-5H3