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

Systemtic Name: 4-[3-(1-naphthalen-2-ylcarbonylpiperidin-4-yl)phenoxy]butanoic acid Openeye Name: 4-[3-[1-(naphthalene-2-carbonyl)-4-piperidyl]phenoxy]butanoic acid CAS Name: 4-[3-[1-[2-naphthalenyl(oxo)methyl]-4-piperidinyl]phenoxy]butanoic acid IUPAC Name: 4-[3-[1-(naphthalene-2-carbonyl)piperidin-4-yl]phenoxy]butanoic acid Traditional Name: 4-[3-[1-(2-naphthoyl)-4-piperidyl]phenoxy]butyric acid Formula: C26H27NO4 MolecularWeight: 417.49688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=CC(=CC=C2)OCCCC(=O)O)C(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CN(CCC1C2=CC(=CC=C2)OCCCC(=O)O)C(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C26H27NO4/c28-25(29)9-4-16-31-24-8-3-7-22(18-24)20-12-14-27(15-13-20)26(30)23-11-10-19-5-1-2-6-21(19)17-23/h1-3,5-8,10-11,17-18,20H,4,9,12-16H2,(H,28,29)