methyl 2-[4-(4-chloranyl-3-methyl-phenoxy)butanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

Systemtic Name: methyl 2-[4-(4-chloranyl-3-methyl-phenoxy)butanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Openeye Name: methyl 2-[4-(4-chloro-3-methyl-phenoxy)butanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate CAS Name: 2-[[4-(4-chloro-3-methylphenoxy)-1-oxobutyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[4-(4-chloro-3-methylphenoxy)butanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Traditional Name: 2-[4-(4-chloro-3-methyl-phenoxy)butanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid methyl ester Formula: C20H22ClNO4S MolecularWeight: 407.91098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCCC(=O)NC2=C(C3=C(S2)CCC3)C(=O)OC)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCCCC(=O)NC2=C(C3=C(S2)CCC3)C(=O)OC)Cl

InChI

InChI=1S/C20H22ClNO4S/c1-12-11-13(8-9-15(12)21)26-10-4-7-17(23)22-19-18(20(24)25-2)14-5-3-6-16(14)27-19/h8-9,11H,3-7,10H2,1-2H3,(H,22,23)