4-[3-[4-(3-chlorophenyl)piperazin-1-yl]propoxy]benzoic acid

Systemtic Name: 4-[3-[4-(3-chlorophenyl)piperazin-1-yl]propoxy]benzoic acid Openeye Name: 4-[3-[4-(3-chlorophenyl)piperazin-1-yl]propoxy]benzoic acid CAS Name: 4-[3-[4-(3-chlorophenyl)-1-piperazinyl]propoxy]benzoic acid IUPAC Name: 4-[3-[4-(3-chlorophenyl)piperazin-1-yl]propoxy]benzoic acid Traditional Name: 4-[3-[4-(3-chlorophenyl)piperazino]propoxy]benzoic acid Formula: C20H23ClN2O3 MolecularWeight: 374.86122

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCOC2=CC=C(C=C2)C(=O)O)C3=CC(=CC=C3)Cl

Isomeric SMILES

C1CN(CCN1CCCOC2=CC=C(C=C2)C(=O)O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H23ClN2O3/c21-17-3-1-4-18(15-17)23-12-10-22(11-13-23)9-2-14-26-19-7-5-16(6-8-19)20(24)25/h1,3-8,15H,2,9-14H2,(H,24,25)