[2-[(4-dimethylaminophenyl)amino]-2-oxidanylidene-ethyl] 4-(4-chloranyl-2-methyl-phenoxy)butanoate

Systemtic Name: [2-[(4-dimethylaminophenyl)amino]-2-oxidanylidene-ethyl] 4-(4-chloranyl-2-methyl-phenoxy)butanoate Openeye Name: [2-[4-(dimethylamino)anilino]-2-oxo-ethyl] 4-(4-chloro-2-methyl-phenoxy)butanoate CAS Name: 4-(4-chloro-2-methylphenoxy)butanoic acid [2-[4-(dimethylamino)anilino]-2-oxoethyl] ester IUPAC Name: [2-[4-(dimethylamino)anilino]-2-oxoethyl] 4-(4-chloro-2-methylphenoxy)butanoate Traditional Name: 4-(4-chloro-2-methyl-phenoxy)butyric acid [2-[4-(dimethylamino)anilino]-2-keto-ethyl] ester Formula: C21H25ClN2O4 MolecularWeight: 404.8872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCCCC(=O)OCC(=O)NC2=CC=C(C=C2)N(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCCCC(=O)OCC(=O)NC2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C21H25ClN2O4/c1-15-13-16(22)6-11-19(15)27-12-4-5-21(26)28-14-20(25)23-17-7-9-18(10-8-17)24(2)3/h6-11,13H,4-5,12,14H2,1-3H3,(H,23,25)