3-[[4-(2,3-dimethylphenyl)piperazin-1-yl]methoxy]benzoic acid

Systemtic Name: 3-[[4-(2,3-dimethylphenyl)piperazin-1-yl]methoxy]benzoic acid Openeye Name: 3-[[4-(2,3-dimethylphenyl)piperazin-1-yl]methoxy]benzoic acid CAS Name: 3-[[4-(2,3-dimethylphenyl)-1-piperazinyl]methoxy]benzoic acid IUPAC Name: 3-[[4-(2,3-dimethylphenyl)piperazin-1-yl]methoxy]benzoic acid Traditional Name: 3-[[4-(2,3-dimethylphenyl)piperazino]methoxy]benzoic acid Formula: C20H24N2O3 MolecularWeight: 340.41616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)COC3=CC=CC(=C3)C(=O)O)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)COC3=CC=CC(=C3)C(=O)O)C

InChI

InChI=1S/C20H24N2O3/c1-15-5-3-8-19(16(15)2)22-11-9-21(10-12-22)14-25-18-7-4-6-17(13-18)20(23)24/h3-8,13H,9-12,14H2,1-2H3,(H,23,24)