methyl 3-[(2R)-1-[4,4-bis(3-methylthiophen-2-yl)but-3-enyl]pyrrolidin-2-yl]propanoate

Systemtic Name: methyl 3-[(2R)-1-[4,4-bis(3-methylthiophen-2-yl)but-3-enyl]pyrrolidin-2-yl]propanoate Openeye Name: methyl 3-[(2R)-1-[4,4-bis(3-methyl-2-thienyl)but-3-enyl]pyrrolidin-2-yl]propanoate CAS Name: 3-[(2R)-1-[4,4-bis(3-methyl-2-thiophenyl)but-3-enyl]-2-pyrrolidinyl]propanoic acid methyl ester IUPAC Name: methyl 3-[(2R)-1-[4,4-bis(3-methylthiophen-2-yl)but-3-enyl]pyrrolidin-2-yl]propanoate Traditional Name: 3-[(2R)-1-[4,4-bis(3-methyl-2-thienyl)but-3-enyl]pyrrolidin-2-yl]propionic acid methyl ester Formula: C22H29NO2S2 MolecularWeight: 403.60116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C(=CCCN2CCCC2CCC(=O)OC)C3=C(C=CS3)C

Isomeric SMILES

CC1=C(SC=C1)C(=CCCN2CCC[C@@H]2CCC(=O)OC)C3=C(C=CS3)C

InChI

InChI=1S/C22H29NO2S2/c1-16-10-14-26-21(16)19(22-17(2)11-15-27-22)7-5-13-23-12-4-6-18(23)8-9-20(24)25-3/h7,10-11,14-15,18H,4-6,8-9,12-13H2,1-3H3/t18-/m1/s1