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

Systemtic Name: methyl 2-[3-[4-(phenylmethyl)piperazin-1-yl]propoxy]benzoate dihydrochloride Openeye Name: methyl 2-[3-(4-benzylpiperazin-1-yl)propoxy]benzoate dihydrochloride CAS Name: 2-[3-[4-(phenylmethyl)-1-piperazinyl]propoxy]benzoic acid methyl ester dihydrochloride IUPAC Name: methyl 2-[3-(4-benzylpiperazin-1-yl)propoxy]benzoate dihydrochloride Traditional Name: 2-[3-(4-benzylpiperazino)propoxy]benzoic acid methyl ester dihydrochloride Formula: C22H30Cl2N2O3 MolecularWeight: 441.3912

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28N2O3.2ClH/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;2*1H