ethyl 4-[3-(2,5-dihydropyrrol-1-ylmethyl)phenyl]-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[3-(2,5-dihydropyrrol-1-ylmethyl)phenyl]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-[3-(2,5-dihydropyrrol-1-ylmethyl)phenyl]-4-oxo-butanoate CAS Name: 4-[3-(2,5-dihydropyrrol-1-ylmethyl)phenyl]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[3-(2,5-dihydropyrrol-1-ylmethyl)phenyl]-4-oxobutanoate Traditional Name: 4-keto-4-[3-(3-pyrrolin-1-ylmethyl)phenyl]butyric acid ethyl ester Formula: C17H21NO3 MolecularWeight: 287.35354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)C1=CC(=CC=C1)CN2CC=CC2

Isomeric SMILES

CCOC(=O)CCC(=O)C1=CC(=CC=C1)CN2CC=CC2

InChI

InChI=1S/C17H21NO3/c1-2-21-17(20)9-8-16(19)15-7-5-6-14(12-15)13-18-10-3-4-11-18/h3-7,12H,2,8-11,13H2,1H3