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

Systemtic Name: 4-[2-[4-(3-methylphenyl)piperazin-1-yl]ethoxy]benzoic acid Openeye Name: 4-[2-[4-(m-tolyl)piperazin-1-yl]ethoxy]benzoic acid CAS Name: 4-[2-[4-(3-methylphenyl)-1-piperazinyl]ethoxy]benzoic acid IUPAC Name: 4-[2-[4-(3-methylphenyl)piperazin-1-yl]ethoxy]benzoic acid Traditional Name: 4-[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=C(C=C3)C(=O)O

Isomeric SMILES

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

InChI

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