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

Systemtic Name: ethyl 2-[2-(3-methylphenoxy)butanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Openeye Name: ethyl 2-[2-(3-methylphenoxy)butanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate CAS Name: 2-[[2-(3-methylphenoxy)-1-oxobutyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[2-(3-methylphenoxy)butanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Traditional Name: 2-[2-(3-methylphenoxy)butanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid ethyl ester Formula: C21H25NO4S MolecularWeight: 387.4925

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C2=C(S1)CCC2)C(=O)OCC)OC3=CC=CC(=C3)C

Isomeric SMILES

CCC(C(=O)NC1=C(C2=C(S1)CCC2)C(=O)OCC)OC3=CC=CC(=C3)C

InChI

InChI=1S/C21H25NO4S/c1-4-16(26-14-9-6-8-13(3)12-14)19(23)22-20-18(21(24)25-5-2)15-10-7-11-17(15)27-20/h6,8-9,12,16H,4-5,7,10-11H2,1-3H3,(H,22,23)