tert-butyl 1-[2-[5-[(E,3S)-3-methyl-4-oxidanyl-but-1-enyl]thiophen-2-yl]-2-oxidanylidene-ethanoyl]pyrrolidine-2-carboxylate

Systemtic Name: tert-butyl 1-[2-[5-[(E,3S)-3-methyl-4-oxidanyl-but-1-enyl]thiophen-2-yl]-2-oxidanylidene-ethanoyl]pyrrolidine-2-carboxylate Openeye Name: tert-butyl 1-[2-[5-[(E,3S)-4-hydroxy-3-methyl-but-1-enyl]-2-thienyl]-2-oxo-acetyl]pyrrolidine-2-carboxylate CAS Name: 1-[2-[5-[(E,3S)-4-hydroxy-3-methylbut-1-enyl]-2-thiophenyl]-1,2-dioxoethyl]-2-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-[2-[5-[(E,3S)-4-hydroxy-3-methylbut-1-enyl]thiophen-2-yl]-2-oxoacetyl]pyrrolidine-2-carboxylate Traditional Name: 1-[2-[5-[(E,3S)-4-hydroxy-3-methyl-but-1-enyl]-2-thienyl]-2-keto-acetyl]pyrrolidine-2-carboxylic acid tert-butyl ester Formula: C20H27NO5S MolecularWeight: 393.49708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CO)C=CC1=CC=C(S1)C(=O)C(=O)N2CCCC2C(=O)OC(C)(C)C

Isomeric SMILES

C[C@H](CO)/C=C/C1=CC=C(S1)C(=O)C(=O)N2CCCC2C(=O)OC(C)(C)C

InChI

InChI=1S/C20H27NO5S/c1-13(12-22)7-8-14-9-10-16(27-14)17(23)18(24)21-11-5-6-15(21)19(25)26-20(2,3)4/h7-10,13,15,22H,5-6,11-12H2,1-4H3/b8-7+/t13-,15?/m0/s1