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

Systemtic Name: 3-chloranyl-N-[(1S)-1-(2,5-dimethoxyphenyl)ethyl]-4-methyl-5-nitro-benzenesulfonamide Openeye Name: 3-chloro-N-[(1S)-1-(2,5-dimethoxyphenyl)ethyl]-4-methyl-5-nitro-benzenesulfonamide CAS Name: 3-chloro-N-[(1S)-1-(2,5-dimethoxyphenyl)ethyl]-4-methyl-5-nitrobenzenesulfonamide IUPAC Name: 3-chloro-N-[(1S)-1-(2,5-dimethoxyphenyl)ethyl]-4-methyl-5-nitrobenzenesulfonamide Traditional Name: 3-chloro-N-[(1S)-1-(2,5-dimethoxyphenyl)ethyl]-4-methyl-5-nitro-benzenesulfonamide Formula: C17H19ClN2O6S MolecularWeight: 414.86056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)NC(C)C2=C(C=CC(=C2)OC)OC)Cl

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)N[C@@H](C)C2=C(C=CC(=C2)OC)OC)Cl

InChI

InChI=1S/C17H19ClN2O6S/c1-10-15(18)8-13(9-16(10)20(21)22)27(23,24)19-11(2)14-7-12(25-3)5-6-17(14)26-4/h5-9,11,19H,1-4H3/t11-/m0/s1