ethyl 7-[4-(2,5-dihydropyrrol-1-ylmethyl)phenyl]-7-oxidanylidene-heptanoate

Systemtic Name: ethyl 7-[4-(2,5-dihydropyrrol-1-ylmethyl)phenyl]-7-oxidanylidene-heptanoate Openeye Name: ethyl 7-[4-(2,5-dihydropyrrol-1-ylmethyl)phenyl]-7-oxo-heptanoate CAS Name: 7-[4-(2,5-dihydropyrrol-1-ylmethyl)phenyl]-7-oxoheptanoic acid ethyl ester IUPAC Name: ethyl 7-[4-(2,5-dihydropyrrol-1-ylmethyl)phenyl]-7-oxoheptanoate Traditional Name: 7-keto-7-[4-(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=C(C=C1)CN2CC=CC2

Isomeric SMILES

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

InChI

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