4-[[(E)-2-cyano-3-(4-ethyl-3-nitro-phenyl)prop-2-enoyl]amino]-N,N-dimethyl-benzamide

Systemtic Name: 4-[[(E)-2-cyano-3-(4-ethyl-3-nitro-phenyl)prop-2-enoyl]amino]-N,N-dimethyl-benzamide Openeye Name: 4-[[(E)-2-cyano-3-(4-ethyl-3-nitro-phenyl)prop-2-enoyl]amino]-N,N-dimethyl-benzamide CAS Name: 4-[[(E)-2-cyano-3-(4-ethyl-3-nitrophenyl)-1-oxoprop-2-enyl]amino]-N,N-dimethylbenzamide IUPAC Name: 4-[[(E)-2-cyano-3-(4-ethyl-3-nitrophenyl)prop-2-enoyl]amino]-N,N-dimethylbenzamide Traditional Name: 4-[[(E)-2-cyano-3-(4-ethyl-3-nitro-phenyl)acryloyl]amino]-N,N-dimethyl-benzamide Formula: C21H20N4O4 MolecularWeight: 392.4079

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)C=C(C#N)C(=O)NC2=CC=C(C=C2)C(=O)N(C)C)[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C=C(C=C1)/C=C(\C#N)/C(=O)NC2=CC=C(C=C2)C(=O)N(C)C)[N+](=O)[O-]

InChI

InChI=1S/C21H20N4O4/c1-4-15-6-5-14(12-19(15)25(28)29)11-17(13-22)20(26)23-18-9-7-16(8-10-18)21(27)24(2)3/h5-12H,4H2,1-3H3,(H,23,26)/b17-11+