2-[2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-oxidanylidene-ethoxy]-3-propan-2-yl-benzoic acid

Systemtic Name: 2-[2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-oxidanylidene-ethoxy]-3-propan-2-yl-benzoic acid Openeye Name: 2-[2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-oxo-ethoxy]-3-isopropyl-benzoic acid CAS Name: 2-[2-[4-[(4-chlorophenyl)methyl]-1-piperazinyl]-2-oxoethoxy]-3-propan-2-ylbenzoic acid IUPAC Name: 2-[2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-oxoethoxy]-3-propan-2-ylbenzoic acid Traditional Name: 2-[2-[4-(4-chlorobenzyl)piperazino]-2-keto-ethoxy]-3-isopropyl-benzoic acid Formula: C23H27ClN2O4 MolecularWeight: 430.92448

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC(=C1OCC(=O)N2CCN(CC2)CC3=CC=C(C=C3)Cl)C(=O)O

Isomeric SMILES

CC(C)C1=CC=CC(=C1OCC(=O)N2CCN(CC2)CC3=CC=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C23H27ClN2O4/c1-16(2)19-4-3-5-20(23(28)29)22(19)30-15-21(27)26-12-10-25(11-13-26)14-17-6-8-18(24)9-7-17/h3-9,16H,10-15H2,1-2H3,(H,28,29)