methyl (E)-2-[(4-chloranyl-2-methyl-phenyl)amino]-5,5-dimethyl-4-oxidanylidene-hex-2-enoate

Systemtic Name: methyl (E)-2-[(4-chloranyl-2-methyl-phenyl)amino]-5,5-dimethyl-4-oxidanylidene-hex-2-enoate Openeye Name: methyl (E)-2-(4-chloro-2-methyl-anilino)-5,5-dimethyl-4-oxo-hex-2-enoate CAS Name: (E)-2-(4-chloro-2-methylanilino)-5,5-dimethyl-4-oxo-2-hexenoic acid methyl ester IUPAC Name: methyl (E)-2-(4-chloro-2-methylanilino)-5,5-dimethyl-4-oxohex-2-enoate Traditional Name: (E)-2-(4-chloro-2-methyl-anilino)-4-keto-5,5-dimethyl-hex-2-enoic acid methyl ester Formula: C16H20ClNO3 MolecularWeight: 309.7879

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)NC(=CC(=O)C(C)(C)C)C(=O)OC

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)N/C(=C/C(=O)C(C)(C)C)/C(=O)OC

InChI

InChI=1S/C16H20ClNO3/c1-10-8-11(17)6-7-12(10)18-13(15(20)21-5)9-14(19)16(2,3)4/h6-9,18H,1-5H3/b13-9+