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

Systemtic Name: N-[(4-methoxy-3-nitro-phenyl)methylideneamino]-2-[methylsulfonyl(phenethyl)amino]ethanamide Openeye Name: N-[(4-methoxy-3-nitro-phenyl)methyleneamino]-2-[methylsulfonyl(phenethyl)amino]acetamide CAS Name: N-[(4-methoxy-3-nitrophenyl)methylideneamino]-2-[methylsulfonyl(phenethyl)amino]acetamide IUPAC Name: N-[(4-methoxy-3-nitrophenyl)methylideneamino]-2-[methylsulfonyl(phenethyl)amino]acetamide Traditional Name: 2-[mesyl(phenethyl)amino]-N-[(4-methoxy-3-nitro-benzylidene)amino]acetamide Formula: C19H22N4O6S MolecularWeight: 434.46618

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=NNC(=O)CN(CCC2=CC=CC=C2)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C=NNC(=O)CN(CCC2=CC=CC=C2)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O6S/c1-29-18-9-8-16(12-17(18)23(25)26)13-20-21-19(24)14-22(30(2,27)28)11-10-15-6-4-3-5-7-15/h3-9,12-13H,10-11,14H2,1-2H3,(H,21,24)