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

Systemtic Name: 4-chloranyl-N-[(1R)-1-(2,5-dimethoxyphenyl)ethyl]-3-nitro-benzenesulfonamide Openeye Name: 4-chloro-N-[(1R)-1-(2,5-dimethoxyphenyl)ethyl]-3-nitro-benzenesulfonamide CAS Name: 4-chloro-N-[(1R)-1-(2,5-dimethoxyphenyl)ethyl]-3-nitrobenzenesulfonamide IUPAC Name: 4-chloro-N-[(1R)-1-(2,5-dimethoxyphenyl)ethyl]-3-nitrobenzenesulfonamide Traditional Name: 4-chloro-N-[(1R)-1-(2,5-dimethoxyphenyl)ethyl]-3-nitro-benzenesulfonamide Formula: C16H17ClN2O6S MolecularWeight: 400.83398

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=CC(=C1)OC)OC)NS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C1=C(C=CC(=C1)OC)OC)NS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H17ClN2O6S/c1-10(13-8-11(24-2)4-7-16(13)25-3)18-26(22,23)12-5-6-14(17)15(9-12)19(20)21/h4-10,18H,1-3H3/t10-/m1/s1