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

Systemtic Name: dimethyl 2-(3-methylbutanoylamino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate Openeye Name: dimethyl 2-(3-methylbutanoylamino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate CAS Name: 2-[(3-methyl-1-oxobutyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-(3-methylbutanoylamino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate Traditional Name: 2-(isovalerylamino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylic acid dimethyl ester Formula: C16H21NO5S MolecularWeight: 339.40664

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=C(C2=C(S1)CCC2C(=O)OC)C(=O)OC

Isomeric SMILES

CC(C)CC(=O)NC1=C(C2=C(S1)CCC2C(=O)OC)C(=O)OC

InChI

InChI=1S/C16H21NO5S/c1-8(2)7-11(18)17-14-13(16(20)22-4)12-9(15(19)21-3)5-6-10(12)23-14/h8-9H,5-7H2,1-4H3,(H,17,18)