dimethyl (4S)-2-(4-phenoxybutanoylamino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate

Systemtic Name: dimethyl (4S)-2-(4-phenoxybutanoylamino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate Openeye Name: dimethyl (4S)-2-(4-phenoxybutanoylamino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate CAS Name: (4S)-2-[(1-oxo-4-phenoxybutyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (4S)-2-(4-phenoxybutanoylamino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate Traditional Name: (4S)-2-(4-phenoxybutanoylamino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylic acid dimethyl ester Formula: C21H23NO6S MolecularWeight: 417.47542

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCC2=C1C(=C(S2)NC(=O)CCCOC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

COC(=O)[C@H]1CCC2=C1C(=C(S2)NC(=O)CCCOC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C21H23NO6S/c1-26-20(24)14-10-11-15-17(14)18(21(25)27-2)19(29-15)22-16(23)9-6-12-28-13-7-4-3-5-8-13/h3-5,7-8,14H,6,9-12H2,1-2H3,(H,22,23)/t14-/m0/s1