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

Systemtic Name: 3-[4-(2-naphthalen-1-yloxyethanoyl)piperazin-1-yl]benzoic acid Openeye Name: 3-[4-[2-(1-naphthyloxy)acetyl]piperazin-1-yl]benzoic acid CAS Name: 3-[4-[2-(1-naphthalenyloxy)-1-oxoethyl]-1-piperazinyl]benzoic acid IUPAC Name: 3-[4-(2-naphthalen-1-yloxyacetyl)piperazin-1-yl]benzoic acid Traditional Name: 3-[4-[2-(1-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=CC=CC4=CC=CC=C43

Isomeric SMILES

C1CN(CCN1C2=CC=CC(=C2)C(=O)O)C(=O)COC3=CC=CC4=CC=CC=C43

InChI

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