dimethyl 5-[4-(4-chloranyl-2-methyl-phenoxy)butanoylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-[4-(4-chloranyl-2-methyl-phenoxy)butanoylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-[4-(4-chloro-2-methyl-phenoxy)butanoylamino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[4-(4-chloro-2-methylphenoxy)-1-oxobutyl]amino]-3-methylthiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[4-(4-chloro-2-methylphenoxy)butanoylamino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[4-(4-chloro-2-methyl-phenoxy)butanoylamino]-3-methyl-thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C20H22ClNO6S MolecularWeight: 439.90978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCCCC(=O)NC2=C(C(=C(S2)C(=O)OC)C)C(=O)OC

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCCCC(=O)NC2=C(C(=C(S2)C(=O)OC)C)C(=O)OC

InChI

InChI=1S/C20H22ClNO6S/c1-11-10-13(21)7-8-14(11)28-9-5-6-15(23)22-18-16(19(24)26-3)12(2)17(29-18)20(25)27-4/h7-8,10H,5-6,9H2,1-4H3,(H,22,23)