N-[(4-methoxy-3-nitro-phenyl)methylideneamino]-2-[methylsulfonyl-(phenylmethyl)amino]ethanamide

Systemtic Name: N-[(4-methoxy-3-nitro-phenyl)methylideneamino]-2-[methylsulfonyl-(phenylmethyl)amino]ethanamide Openeye Name: 2-[benzyl(methylsulfonyl)amino]-N-[(4-methoxy-3-nitro-phenyl)methyleneamino]acetamide CAS Name: N-[(4-methoxy-3-nitrophenyl)methylideneamino]-2-[methylsulfonyl-(phenylmethyl)amino]acetamide IUPAC Name: 2-[benzyl(methylsulfonyl)amino]-N-[(4-methoxy-3-nitrophenyl)methylideneamino]acetamide Traditional Name: 2-[benzyl(mesyl)amino]-N-[(4-methoxy-3-nitro-benzylidene)amino]acetamide Formula: C18H20N4O6S MolecularWeight: 420.4396

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=NNC(=O)CN(CC2=CC=CC=C2)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C=NNC(=O)CN(CC2=CC=CC=C2)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C18H20N4O6S/c1-28-17-9-8-15(10-16(17)22(24)25)11-19-20-18(23)13-21(29(2,26)27)12-14-6-4-3-5-7-14/h3-11H,12-13H2,1-2H3,(H,20,23)