3-[2-[4-(3-methylphenyl)piperazin-1-yl]ethoxy]benzoic acid

Systemtic Name: 3-[2-[4-(3-methylphenyl)piperazin-1-yl]ethoxy]benzoic acid Openeye Name: 3-[2-[4-(m-tolyl)piperazin-1-yl]ethoxy]benzoic acid CAS Name: 3-[2-[4-(3-methylphenyl)-1-piperazinyl]ethoxy]benzoic acid IUPAC Name: 3-[2-[4-(3-methylphenyl)piperazin-1-yl]ethoxy]benzoic acid Traditional Name: 3-[2-[4-(m-tolyl)piperazino]ethoxy]benzoic acid Formula: C20H24N2O3 MolecularWeight: 340.41616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)CCOC3=CC=CC(=C3)C(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)CCOC3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C20H24N2O3/c1-16-4-2-6-18(14-16)22-10-8-21(9-11-22)12-13-25-19-7-3-5-17(15-19)20(23)24/h2-7,14-15H,8-13H2,1H3,(H,23,24)