methyl 3-[4-(4-methylpiperazin-1-yl)-1-(phenylmethyl)piperidin-3-yl]propanoate

Systemtic Name: methyl 3-[4-(4-methylpiperazin-1-yl)-1-(phenylmethyl)piperidin-3-yl]propanoate Openeye Name: methyl 3-[1-benzyl-4-(4-methylpiperazin-1-yl)-3-piperidyl]propanoate CAS Name: 3-[4-(4-methyl-1-piperazinyl)-1-(phenylmethyl)-3-piperidinyl]propanoic acid methyl ester IUPAC Name: methyl 3-[1-benzyl-4-(4-methylpiperazin-1-yl)piperidin-3-yl]propanoate Traditional Name: 3-[1-benzyl-4-(4-methylpiperazino)-3-piperidyl]propionic acid methyl ester Formula: C21H33N3O2 MolecularWeight: 359.50562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2CCN(CC2CCC(=O)OC)CC3=CC=CC=C3

Isomeric SMILES

CN1CCN(CC1)C2CCN(CC2CCC(=O)OC)CC3=CC=CC=C3

InChI

InChI=1S/C21H33N3O2/c1-22-12-14-24(15-13-22)20-10-11-23(16-18-6-4-3-5-7-18)17-19(20)8-9-21(25)26-2/h3-7,19-20H,8-17H2,1-2H3