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

Systemtic Name: 3-chloranyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-4-methyl-5-nitro-benzenesulfonamide Openeye Name: 3-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-4-methyl-5-nitro-benzenesulfonamide CAS Name: 3-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-4-methyl-5-nitrobenzenesulfonamide IUPAC Name: 3-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-4-methyl-5-nitrobenzenesulfonamide Traditional Name: 3-chloro-N-homoveratryl-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)NCCC2=CC(=C(C=C2)OC)OC)Cl

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)NCCC2=CC(=C(C=C2)OC)OC)Cl

InChI

InChI=1S/C17H19ClN2O6S/c1-11-14(18)9-13(10-15(11)20(21)22)27(23,24)19-7-6-12-4-5-16(25-2)17(8-12)26-3/h4-5,8-10,19H,6-7H2,1-3H3