N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-3-methylsulfanyl-propanamide

Systemtic Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-3-methylsulfanyl-propanamide Openeye Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-3-methylsulfanyl-propanamide CAS Name: N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-3-(methylthio)propanamide IUPAC Name: N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-3-methylsulfanylpropanamide Traditional Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-3-(methylthio)propionamide Formula: C14H20N2O5S MolecularWeight: 328.384

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CCNC(=O)CCSC)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CCNC(=O)CCSC)[N+](=O)[O-])OC

InChI

InChI=1S/C14H20N2O5S/c1-20-12-8-10(4-6-15-14(17)5-7-22-3)11(16(18)19)9-13(12)21-2/h8-9H,4-7H2,1-3H3,(H,15,17)