2-[4-[8-(3-cyanophenyl)-1,7-naphthyridin-6-yl]piperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-[8-(3-cyanophenyl)-1,7-naphthyridin-6-yl]piperazin-1-yl]ethanoic acid Openeye Name: 2-[4-[8-(3-cyanophenyl)-1,7-naphthyridin-6-yl]piperazin-1-yl]acetic acid CAS Name: 2-[4-[8-(3-cyanophenyl)-1,7-naphthyridin-6-yl]-1-piperazinyl]acetic acid IUPAC Name: 2-[4-[8-(3-cyanophenyl)-1,7-naphthyridin-6-yl]piperazin-1-yl]acetic acid Traditional Name: 2-[4-[8-(3-cyanophenyl)-1,7-naphthyridin-6-yl]piperazino]acetic acid Formula: C21H19N5O2 MolecularWeight: 373.40786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)O)C2=NC(=C3C(=C2)C=CC=N3)C4=CC=CC(=C4)C#N

Isomeric SMILES

C1CN(CCN1CC(=O)O)C2=NC(=C3C(=C2)C=CC=N3)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C21H19N5O2/c22-13-15-3-1-4-16(11-15)21-20-17(5-2-6-23-20)12-18(24-21)26-9-7-25(8-10-26)14-19(27)28/h1-6,11-12H,7-10,14H2,(H,27,28)