4-[[(1R)-1-(2,5-dimethoxyphenyl)ethyl]amino]-N-methyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-[[(1R)-1-(2,5-dimethoxyphenyl)ethyl]amino]-N-methyl-3-nitro-benzenesulfonamide Openeye Name: 4-[[(1R)-1-(2,5-dimethoxyphenyl)ethyl]amino]-N-methyl-3-nitro-benzenesulfonamide CAS Name: 4-[[(1R)-1-(2,5-dimethoxyphenyl)ethyl]amino]-N-methyl-3-nitrobenzenesulfonamide IUPAC Name: 4-[[(1R)-1-(2,5-dimethoxyphenyl)ethyl]amino]-N-methyl-3-nitrobenzenesulfonamide Traditional Name: 4-[[(1R)-1-(2,5-dimethoxyphenyl)ethyl]amino]-N-methyl-3-nitro-benzenesulfonamide Formula: C17H21N3O6S MolecularWeight: 395.43014

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=CC(=C1)OC)OC)NC2=C(C=C(C=C2)S(=O)(=O)NC)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C1=C(C=CC(=C1)OC)OC)NC2=C(C=C(C=C2)S(=O)(=O)NC)[N+](=O)[O-]

InChI

InChI=1S/C17H21N3O6S/c1-11(14-9-12(25-3)5-8-17(14)26-4)19-15-7-6-13(27(23,24)18-2)10-16(15)20(21)22/h5-11,18-19H,1-4H3/t11-/m1/s1