4-[[(E)-2-cyano-3-(2,5-dimethylphenyl)prop-2-enoyl]amino]-N,N-dimethyl-benzamide

Systemtic Name: 4-[[(E)-2-cyano-3-(2,5-dimethylphenyl)prop-2-enoyl]amino]-N,N-dimethyl-benzamide Openeye Name: 4-[[(E)-2-cyano-3-(2,5-dimethylphenyl)prop-2-enoyl]amino]-N,N-dimethyl-benzamide CAS Name: 4-[[(E)-2-cyano-3-(2,5-dimethylphenyl)-1-oxoprop-2-enyl]amino]-N,N-dimethylbenzamide IUPAC Name: 4-[[(E)-2-cyano-3-(2,5-dimethylphenyl)prop-2-enoyl]amino]-N,N-dimethylbenzamide Traditional Name: 4-[[(E)-2-cyano-3-(2,5-dimethylphenyl)acryloyl]amino]-N,N-dimethyl-benzamide Formula: C21H21N3O2 MolecularWeight: 347.41034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C=C(C#N)C(=O)NC2=CC=C(C=C2)C(=O)N(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)/C=C(\C#N)/C(=O)NC2=CC=C(C=C2)C(=O)N(C)C

InChI

InChI=1S/C21H21N3O2/c1-14-5-6-15(2)17(11-14)12-18(13-22)20(25)23-19-9-7-16(8-10-19)21(26)24(3)4/h5-12H,1-4H3,(H,23,25)/b18-12+