2-[2-[4-(6-azanylpyridin-2-yl)phenyl]ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid

Systemtic Name: 2-[2-[4-(6-azanylpyridin-2-yl)phenyl]ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Openeye Name: 2-[2-[4-(6-amino-2-pyridyl)phenyl]ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid CAS Name: 2-[2-[4-(6-amino-2-pyridinyl)phenyl]ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid IUPAC Name: 2-[2-[4-(6-aminopyridin-2-yl)phenyl]ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Traditional Name: 2-[2-[4-(6-amino-2-pyridyl)phenyl]ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Formula: C23H23N3O2 MolecularWeight: 373.44762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CC2=CC=CC=C21)CCC3=CC=C(C=C3)C4=NC(=CC=C4)N)C(=O)O

Isomeric SMILES

C1C(N(CC2=CC=CC=C21)CCC3=CC=C(C=C3)C4=NC(=CC=C4)N)C(=O)O

InChI

InChI=1S/C23H23N3O2/c24-22-7-3-6-20(25-22)17-10-8-16(9-11-17)12-13-26-15-19-5-2-1-4-18(19)14-21(26)23(27)28/h1-11,21H,12-15H2,(H2,24,25)(H,27,28)