methyl 2-[[(E)-but-2-enoyl]-(2,6-dimethylphenyl)amino]-4-chloranyl-butanoate

Systemtic Name: methyl 2-[[(E)-but-2-enoyl]-(2,6-dimethylphenyl)amino]-4-chloranyl-butanoate Openeye Name: methyl 2-(N-[(E)-but-2-enoyl]-2,6-dimethyl-anilino)-4-chloro-butanoate CAS Name: 4-chloro-2-(2,6-dimethyl-N-[(E)-1-oxobut-2-enyl]anilino)butanoic acid methyl ester IUPAC Name: methyl 2-(N-[(E)-but-2-enoyl]-2,6-dimethylanilino)-4-chlorobutanoate Traditional Name: 2-(N-[(E)-but-2-enoyl]-2,6-dimethyl-anilino)-4-chloro-butyric acid methyl ester Formula: C17H22ClNO3 MolecularWeight: 323.81448

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)N(C1=C(C=CC=C1C)C)C(CCCl)C(=O)OC

Isomeric SMILES

C/C=C/C(=O)N(C1=C(C=CC=C1C)C)C(CCCl)C(=O)OC

InChI

InChI=1S/C17H22ClNO3/c1-5-7-15(20)19(14(10-11-18)17(21)22-4)16-12(2)8-6-9-13(16)3/h5-9,14H,10-11H2,1-4H3/b7-5+