4-(4-naphthalen-2-ylpiperazin-1-yl)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(4-naphthalen-2-ylpiperazin-1-yl)-4-oxidanylidene-butanoic acid Openeye Name: 4-[4-(2-naphthyl)piperazin-1-yl]-4-oxo-butanoic acid CAS Name: 4-[4-(2-naphthalenyl)-1-piperazinyl]-4-oxobutanoic acid IUPAC Name: 4-(4-naphthalen-2-ylpiperazin-1-yl)-4-oxobutanoic acid Traditional Name: 4-keto-4-[4-(2-naphthyl)piperazino]butyric acid Formula: C18H20N2O3 MolecularWeight: 312.363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC3=CC=CC=C3C=C2)C(=O)CCC(=O)O

Isomeric SMILES

C1CN(CCN1C2=CC3=CC=CC=C3C=C2)C(=O)CCC(=O)O

InChI

InChI=1S/C18H20N2O3/c21-17(7-8-18(22)23)20-11-9-19(10-12-20)16-6-5-14-3-1-2-4-15(14)13-16/h1-6,13H,7-12H2,(H,22,23)