6-[[4-[2-(2-methylquinolin-5-yl)oxyethyl]piperazin-1-yl]methyl]-3,4-dihydro-2H-isoquinolin-1-one

Systemtic Name: 6-[[4-[2-(2-methylquinolin-5-yl)oxyethyl]piperazin-1-yl]methyl]-3,4-dihydro-2H-isoquinolin-1-one Openeye Name: 6-[[4-[2-[(2-methyl-5-quinolyl)oxy]ethyl]piperazin-1-yl]methyl]-3,4-dihydro-2H-isoquinolin-1-one CAS Name: 6-[[4-[2-[(2-methyl-5-quinolinyl)oxy]ethyl]-1-piperazinyl]methyl]-3,4-dihydro-2H-isoquinolin-1-one IUPAC Name: 6-[[4-[2-(2-methylquinolin-5-yl)oxyethyl]piperazin-1-yl]methyl]-3,4-dihydro-2H-isoquinolin-1-one Traditional Name: 6-[[4-[2-[(2-methyl-5-quinolyl)oxy]ethyl]piperazino]methyl]-3,4-dihydroisocarbostyril Formula: C26H30N4O2 MolecularWeight: 430.542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C1)C(=CC=C2)OCCN3CCN(CC3)CC4=CC5=C(C=C4)C(=O)NCC5

Isomeric SMILES

CC1=NC2=C(C=C1)C(=CC=C2)OCCN3CCN(CC3)CC4=CC5=C(C=C4)C(=O)NCC5

InChI

InChI=1S/C26H30N4O2/c1-19-5-7-23-24(28-19)3-2-4-25(23)32-16-15-29-11-13-30(14-12-29)18-20-6-8-22-21(17-20)9-10-27-26(22)31/h2-8,17H,9-16,18H2,1H3,(H,27,31)