ethyl (2S)-2-[3-(piperazin-1-ylmethyl)phenoxy]propanoate

Systemtic Name: ethyl (2S)-2-[3-(piperazin-1-ylmethyl)phenoxy]propanoate Openeye Name: ethyl (2S)-2-[3-(piperazin-1-ylmethyl)phenoxy]propanoate CAS Name: (2S)-2-[3-(1-piperazinylmethyl)phenoxy]propanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-[3-(piperazin-1-ylmethyl)phenoxy]propanoate Traditional Name: (2S)-2-[3-(piperazinomethyl)phenoxy]propionic acid ethyl ester Formula: C16H24N2O3 MolecularWeight: 292.37336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)OC1=CC=CC(=C1)CN2CCNCC2

Isomeric SMILES

CCOC(=O)[C@H](C)OC1=CC=CC(=C1)CN2CCNCC2

InChI

InChI=1S/C16H24N2O3/c1-3-20-16(19)13(2)21-15-6-4-5-14(11-15)12-18-9-7-17-8-10-18/h4-6,11,13,17H,3,7-10,12H2,1-2H3/t13-/m0/s1