methyl 3-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]propanoate

Systemtic Name: methyl 3-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]propanoate Openeye Name: methyl 3-[4-(4-benzylpiperazin-1-yl)phenyl]propanoate CAS Name: 3-[4-[4-(phenylmethyl)-1-piperazinyl]phenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-(4-benzylpiperazin-1-yl)phenyl]propanoate Traditional Name: 3-[4-(4-benzylpiperazino)phenyl]propionic acid methyl ester Formula: C21H26N2O2 MolecularWeight: 338.44334

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=CC=C(C=C1)N2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

COC(=O)CCC1=CC=C(C=C1)N2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C21H26N2O2/c1-25-21(24)12-9-18-7-10-20(11-8-18)23-15-13-22(14-16-23)17-19-5-3-2-4-6-19/h2-8,10-11H,9,12-17H2,1H3