3-[4-(2-naphthalen-2-yloxyethanoyl)piperazin-1-yl]benzoic acid

Systemtic Name: 3-[4-(2-naphthalen-2-yloxyethanoyl)piperazin-1-yl]benzoic acid Openeye Name: 3-[4-[2-(2-naphthyloxy)acetyl]piperazin-1-yl]benzoic acid CAS Name: 3-[4-[2-(2-naphthalenyloxy)-1-oxoethyl]-1-piperazinyl]benzoic acid IUPAC Name: 3-[4-(2-naphthalen-2-yloxyacetyl)piperazin-1-yl]benzoic acid Traditional Name: 3-[4-[2-(2-naphthoxy)acetyl]piperazino]benzoic acid Formula: C23H22N2O4 MolecularWeight: 390.43178

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC(=C2)C(=O)O)C(=O)COC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CN(CCN1C2=CC=CC(=C2)C(=O)O)C(=O)COC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C23H22N2O4/c26-22(16-29-21-9-8-17-4-1-2-5-18(17)15-21)25-12-10-24(11-13-25)20-7-3-6-19(14-20)23(27)28/h1-9,14-15H,10-13,16H2,(H,27,28)