methyl 2-[3-[4-(phenylmethyl)piperazin-1-yl]propoxy]benzoate

Systemtic Name: methyl 2-[3-[4-(phenylmethyl)piperazin-1-yl]propoxy]benzoate Openeye Name: methyl 2-[3-(4-benzylpiperazin-1-yl)propoxy]benzoate CAS Name: 2-[3-[4-(phenylmethyl)-1-piperazinyl]propoxy]benzoic acid methyl ester IUPAC Name: methyl 2-[3-(4-benzylpiperazin-1-yl)propoxy]benzoate Traditional Name: 2-[3-(4-benzylpiperazino)propoxy]benzoic acid methyl ester Formula: C22H28N2O3 MolecularWeight: 368.46932

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1OCCCN2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=CC=C1OCCCN2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C22H28N2O3/c1-26-22(25)20-10-5-6-11-21(20)27-17-7-12-23-13-15-24(16-14-23)18-19-8-3-2-4-9-19/h2-6,8-11H,7,12-18H2,1H3