4-[[4-(3-methoxyphenyl)piperazin-1-yl]methyl]benzoic acid

Systemtic Name: 4-[[4-(3-methoxyphenyl)piperazin-1-yl]methyl]benzoic acid Openeye Name: 4-[[4-(3-methoxyphenyl)piperazin-1-yl]methyl]benzoic acid CAS Name: 4-[[4-(3-methoxyphenyl)-1-piperazinyl]methyl]benzoic acid IUPAC Name: 4-[[4-(3-methoxyphenyl)piperazin-1-yl]methyl]benzoic acid Traditional Name: 4-[[4-(3-methoxyphenyl)piperazino]methyl]benzoic acid Formula: C19H22N2O3 MolecularWeight: 326.38958

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CCN(CC2)CC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)CC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C19H22N2O3/c1-24-18-4-2-3-17(13-18)21-11-9-20(10-12-21)14-15-5-7-16(8-6-15)19(22)23/h2-8,13H,9-12,14H2,1H3,(H,22,23)