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

Systemtic Name: ethyl 5-[3-(2,5-dihydropyrrol-1-ylmethyl)phenyl]-5-oxidanylidene-pentanoate Openeye Name: ethyl 5-[3-(2,5-dihydropyrrol-1-ylmethyl)phenyl]-5-oxo-pentanoate CAS Name: 5-[3-(2,5-dihydropyrrol-1-ylmethyl)phenyl]-5-oxopentanoic acid ethyl ester IUPAC Name: ethyl 5-[3-(2,5-dihydropyrrol-1-ylmethyl)phenyl]-5-oxopentanoate Traditional Name: 5-keto-5-[3-(3-pyrrolin-1-ylmethyl)phenyl]valeric acid ethyl ester Formula: C18H23NO3 MolecularWeight: 301.38012

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23NO3/c1-2-22-18(21)10-6-9-17(20)16-8-5-7-15(13-16)14-19-11-3-4-12-19/h3-5,7-8,13H,2,6,9-12,14H2,1H3