methyl (2S)-2-(5-butyl-4-oxidanylidene-1,3,3a,6a-tetrahydrocyclopenta[c]pyrrol-2-yl)-2-phenyl-ethanoate

Systemtic Name: methyl (2S)-2-(5-butyl-4-oxidanylidene-1,3,3a,6a-tetrahydrocyclopenta[c]pyrrol-2-yl)-2-phenyl-ethanoate Openeye Name: methyl (2S)-2-(5-butyl-4-oxo-1,3,3a,6a-tetrahydrocyclopenta[c]pyrrol-2-yl)-2-phenyl-acetate CAS Name: (2S)-2-(5-butyl-4-oxo-1,3,3a,6a-tetrahydrocyclopenta[c]pyrrol-2-yl)-2-phenylacetic acid methyl ester IUPAC Name: methyl (2S)-2-(5-butyl-4-oxo-1,3,3a,6a-tetrahydrocyclopenta[c]pyrrol-2-yl)-2-phenylacetate Traditional Name: (2S)-2-(5-butyl-4-keto-1,3,3a,6a-tetrahydrocyclopenta[c]pyrrol-2-yl)-2-phenyl-acetic acid methyl ester Formula: C20H25NO3 MolecularWeight: 327.4174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2CN(CC2C1=O)C(C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CCCCC1=CC2CN(CC2C1=O)[C@@H](C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C20H25NO3/c1-3-4-8-15-11-16-12-21(13-17(16)19(15)22)18(20(23)24-2)14-9-6-5-7-10-14/h5-7,9-11,16-18H,3-4,8,12-13H2,1-2H3/t16?,17?,18-/m0/s1