ethyl 4-[3-(azetidin-1-ylmethyl)phenyl]-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[3-(azetidin-1-ylmethyl)phenyl]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-[3-(azetidin-1-ylmethyl)phenyl]-4-oxo-butanoate CAS Name: 4-[3-(1-azetidinylmethyl)phenyl]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[3-(azetidin-1-ylmethyl)phenyl]-4-oxobutanoate Traditional Name: 4-[3-(azetidin-1-ylmethyl)phenyl]-4-keto-butyric acid ethyl ester Formula: C16H21NO3 MolecularWeight: 275.34284

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)C1=CC(=CC=C1)CN2CCC2

Isomeric SMILES

CCOC(=O)CCC(=O)C1=CC(=CC=C1)CN2CCC2

InChI

InChI=1S/C16H21NO3/c1-2-20-16(19)8-7-15(18)14-6-3-5-13(11-14)12-17-9-4-10-17/h3,5-6,11H,2,4,7-10,12H2,1H3