2-(2-chloranyl-4-nitro-phenyl)sulfanyl-N-[2-(3,4-dimethoxyphenyl)ethyl]ethanamide

Systemtic Name: 2-(2-chloranyl-4-nitro-phenyl)sulfanyl-N-[2-(3,4-dimethoxyphenyl)ethyl]ethanamide Openeye Name: 2-(2-chloro-4-nitro-phenyl)sulfanyl-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide CAS Name: 2-[(2-chloro-4-nitrophenyl)thio]-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide IUPAC Name: 2-(2-chloro-4-nitrophenyl)sulfanyl-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide Traditional Name: 2-[(2-chloro-4-nitro-phenyl)thio]-N-homoveratryl-acetamide Formula: C18H19ClN2O5S MolecularWeight: 410.87186

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)CSC2=C(C=C(C=C2)[N+](=O)[O-])Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)CSC2=C(C=C(C=C2)[N+](=O)[O-])Cl)OC

InChI

InChI=1S/C18H19ClN2O5S/c1-25-15-5-3-12(9-16(15)26-2)7-8-20-18(22)11-27-17-6-4-13(21(23)24)10-14(17)19/h3-6,9-10H,7-8,11H2,1-2H3,(H,20,22)