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

Systemtic Name: ethyl 5-[2-(2,5-dihydropyrrol-1-ylmethyl)phenyl]-5-oxidanylidene-pentanoate Openeye Name: ethyl 5-[2-(2,5-dihydropyrrol-1-ylmethyl)phenyl]-5-oxo-pentanoate CAS Name: 5-[2-(2,5-dihydropyrrol-1-ylmethyl)phenyl]-5-oxopentanoic acid ethyl ester IUPAC Name: ethyl 5-[2-(2,5-dihydropyrrol-1-ylmethyl)phenyl]-5-oxopentanoate Traditional Name: 5-keto-5-[2-(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=C1CN2CC=CC2

Isomeric SMILES

CCOC(=O)CCCC(=O)C1=CC=CC=C1CN2CC=CC2

InChI

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