N-[(E)-(3-methoxy-4-prop-2-enoxy-phenyl)methylideneamino]-2-[(4-nitrophenyl)methylsulfanyl]ethanamide

Systemtic Name: N-[(E)-(3-methoxy-4-prop-2-enoxy-phenyl)methylideneamino]-2-[(4-nitrophenyl)methylsulfanyl]ethanamide Openeye Name: N-[(E)-(4-allyloxy-3-methoxy-phenyl)methyleneamino]-2-[(4-nitrophenyl)methylsulfanyl]acetamide CAS Name: N-[(E)-(3-methoxy-4-prop-2-enoxyphenyl)methylideneamino]-2-[(4-nitrophenyl)methylthio]acetamide IUPAC Name: N-[(E)-(3-methoxy-4-prop-2-enoxyphenyl)methylideneamino]-2-[(4-nitrophenyl)methylsulfanyl]acetamide Traditional Name: N-[(E)-(4-allyloxy-3-methoxy-benzylidene)amino]-2-[(4-nitrobenzyl)thio]acetamide Formula: C20H21N3O5S MolecularWeight: 415.46284

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=NNC(=O)CSCC2=CC=C(C=C2)[N+](=O)[O-])OCC=C

Isomeric SMILES

COC1=C(C=CC(=C1)/C=N/NC(=O)CSCC2=CC=C(C=C2)[N+](=O)[O-])OCC=C

InChI

InChI=1S/C20H21N3O5S/c1-3-10-28-18-9-6-16(11-19(18)27-2)12-21-22-20(24)14-29-13-15-4-7-17(8-5-15)23(25)26/h3-9,11-12H,1,10,13-14H2,2H3,(H,22,24)/b21-12+