methyl 4-[4-(phenylmethyl)piperazin-1-yl]butanoate

Systemtic Name: methyl 4-[4-(phenylmethyl)piperazin-1-yl]butanoate Openeye Name: methyl 4-(4-benzylpiperazin-1-yl)butanoate CAS Name: 4-[4-(phenylmethyl)-1-piperazinyl]butanoic acid methyl ester IUPAC Name: methyl 4-(4-benzylpiperazin-1-yl)butanoate Traditional Name: 4-(4-benzylpiperazino)butyric acid methyl ester Formula: C16H24N2O2 MolecularWeight: 276.37396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCN1CCN(CC1)CC2=CC=CC=C2

Isomeric SMILES

COC(=O)CCCN1CCN(CC1)CC2=CC=CC=C2

InChI

InChI=1S/C16H24N2O2/c1-20-16(19)8-5-9-17-10-12-18(13-11-17)14-15-6-3-2-4-7-15/h2-4,6-7H,5,8-14H2,1H3