ethyl 2-[4-(4-ethylphenoxy)butanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

Systemtic Name: ethyl 2-[4-(4-ethylphenoxy)butanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Openeye Name: ethyl 2-[4-(4-ethylphenoxy)butanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate CAS Name: 2-[[4-(4-ethylphenoxy)-1-oxobutyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[4-(4-ethylphenoxy)butanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Traditional Name: 2-[4-(4-ethylphenoxy)butanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid ethyl ester Formula: C22H27NO4S MolecularWeight: 401.51908

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCCCC(=O)NC2=C(C3=C(S2)CCC3)C(=O)OCC

Isomeric SMILES

CCC1=CC=C(C=C1)OCCCC(=O)NC2=C(C3=C(S2)CCC3)C(=O)OCC

InChI

InChI=1S/C22H27NO4S/c1-3-15-10-12-16(13-11-15)27-14-6-9-19(24)23-21-20(22(25)26-4-2)17-7-5-8-18(17)28-21/h10-13H,3-9,14H2,1-2H3,(H,23,24)