ethyl 7-[3-(2,5-dihydropyrrol-1-ylmethyl)phenyl]-7-oxidanylidene-heptanoate

Systemtic Name: ethyl 7-[3-(2,5-dihydropyrrol-1-ylmethyl)phenyl]-7-oxidanylidene-heptanoate Openeye Name: ethyl 7-[3-(2,5-dihydropyrrol-1-ylmethyl)phenyl]-7-oxo-heptanoate CAS Name: 7-[3-(2,5-dihydropyrrol-1-ylmethyl)phenyl]-7-oxoheptanoic acid ethyl ester IUPAC Name: ethyl 7-[3-(2,5-dihydropyrrol-1-ylmethyl)phenyl]-7-oxoheptanoate Traditional Name: 7-keto-7-[3-(3-pyrrolin-1-ylmethyl)phenyl]enanthic acid ethyl ester Formula: C20H27NO3 MolecularWeight: 329.43328

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H27NO3/c1-2-24-20(23)12-5-3-4-11-19(22)18-10-8-9-17(15-18)16-21-13-6-7-14-21/h6-10,15H,2-5,11-14,16H2,1H3