(E)-2-cyano-3-[5-nitro-2-(2-oxidanylidene-2-phenylazanyl-ethoxy)phenyl]-N-prop-2-enyl-prop-2-enamide

Systemtic Name: (E)-2-cyano-3-[5-nitro-2-(2-oxidanylidene-2-phenylazanyl-ethoxy)phenyl]-N-prop-2-enyl-prop-2-enamide Openeye Name: (E)-N-allyl-3-[2-(2-anilino-2-oxo-ethoxy)-5-nitro-phenyl]-2-cyano-prop-2-enamide CAS Name: (E)-3-[2-(2-anilino-2-oxoethoxy)-5-nitrophenyl]-2-cyano-N-prop-2-enyl-2-propenamide IUPAC Name: (E)-3-[2-(2-anilino-2-oxoethoxy)-5-nitrophenyl]-2-cyano-N-prop-2-enylprop-2-enamide Traditional Name: (E)-N-allyl-3-[2-(2-anilino-2-keto-ethoxy)-5-nitro-phenyl]-2-cyano-acrylamide Formula: C21H18N4O5 MolecularWeight: 406.39142

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)C(=CC1=C(C=CC(=C1)[N+](=O)[O-])OCC(=O)NC2=CC=CC=C2)C#N

Isomeric SMILES

C=CCNC(=O)/C(=C/C1=C(C=CC(=C1)[N+](=O)[O-])OCC(=O)NC2=CC=CC=C2)/C#N

InChI

InChI=1S/C21H18N4O5/c1-2-10-23-21(27)16(13-22)11-15-12-18(25(28)29)8-9-19(15)30-14-20(26)24-17-6-4-3-5-7-17/h2-9,11-12H,1,10,14H2,(H,23,27)(H,24,26)/b16-11+