4-[3-(4-naphthalen-2-ylcarbonylpiperazin-1-yl)phenoxy]butanoic acid

Systemtic Name: 4-[3-(4-naphthalen-2-ylcarbonylpiperazin-1-yl)phenoxy]butanoic acid Openeye Name: 4-[3-[4-(naphthalene-2-carbonyl)piperazin-1-yl]phenoxy]butanoic acid CAS Name: 4-[3-[4-[2-naphthalenyl(oxo)methyl]-1-piperazinyl]phenoxy]butanoic acid IUPAC Name: 4-[3-[4-(naphthalene-2-carbonyl)piperazin-1-yl]phenoxy]butanoic acid Traditional Name: 4-[3-[4-(2-naphthoyl)piperazino]phenoxy]butyric acid Formula: C25H26N2O4 MolecularWeight: 418.48494

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H26N2O4/c28-24(29)9-4-16-31-23-8-3-7-22(18-23)26-12-14-27(15-13-26)25(30)21-11-10-19-5-1-2-6-20(19)17-21/h1-3,5-8,10-11,17-18H,4,9,12-16H2,(H,28,29)