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

Systemtic Name: ethyl 5-oxidanylidene-5-[2-(pyrrolidin-1-ylmethyl)phenyl]pentanoate Openeye Name: ethyl 5-oxo-5-[2-(pyrrolidin-1-ylmethyl)phenyl]pentanoate CAS Name: 5-oxo-5-[2-(1-pyrrolidinylmethyl)phenyl]pentanoic acid ethyl ester IUPAC Name: ethyl 5-oxo-5-[2-(pyrrolidin-1-ylmethyl)phenyl]pentanoate Traditional Name: 5-keto-5-[2-(pyrrolidinomethyl)phenyl]valeric acid ethyl ester Formula: C18H25NO3 MolecularWeight: 303.396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCC(=O)C1=CC=CC=C1CN2CCCC2

Isomeric SMILES

CCOC(=O)CCCC(=O)C1=CC=CC=C1CN2CCCC2

InChI

InChI=1S/C18H25NO3/c1-2-22-18(21)11-7-10-17(20)16-9-4-3-8-15(16)14-19-12-5-6-13-19/h3-4,8-9H,2,5-7,10-14H2,1H3