N-(2-methoxy-4-nitro-phenyl)-3-phenylsulfanyl-propanamide

Systemtic Name: N-(2-methoxy-4-nitro-phenyl)-3-phenylsulfanyl-propanamide Openeye Name: N-(2-methoxy-4-nitro-phenyl)-3-phenylsulfanyl-propanamide CAS Name: N-(2-methoxy-4-nitrophenyl)-3-(phenylthio)propanamide IUPAC Name: N-(2-methoxy-4-nitrophenyl)-3-phenylsulfanylpropanamide Traditional Name: N-(2-methoxy-4-nitro-phenyl)-3-(phenylthio)propionamide Formula: C16H16N2O4S MolecularWeight: 332.37424

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CCSC2=CC=CC=C2

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CCSC2=CC=CC=C2

InChI

InChI=1S/C16H16N2O4S/c1-22-15-11-12(18(20)21)7-8-14(15)17-16(19)9-10-23-13-5-3-2-4-6-13/h2-8,11H,9-10H2,1H3,(H,17,19)