3-[3,5-dimethyl-4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]-6,8-dimethoxy-2H-isoquinolin-1-one

Systemtic Name: 3-[3,5-dimethyl-4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]-6,8-dimethoxy-2H-isoquinolin-1-one Openeye Name: 3-[3,5-dimethyl-4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]-6,8-dimethoxy-2H-isoquinolin-1-one CAS Name: 3-[3,5-dimethyl-4-[2-(4-methyl-1-piperazinyl)ethoxy]phenyl]-6,8-dimethoxy-2H-isoquinolin-1-one IUPAC Name: 3-[3,5-dimethyl-4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]-6,8-dimethoxy-2H-isoquinolin-1-one Traditional Name: 3-[3,5-dimethyl-4-[2-(4-methylpiperazino)ethoxy]phenyl]-6,8-dimethoxy-isocarbostyril Formula: C26H33N3O4 MolecularWeight: 451.55792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCCN2CCN(CC2)C)C)C3=CC4=CC(=CC(=C4C(=O)N3)OC)OC

Isomeric SMILES

CC1=CC(=CC(=C1OCCN2CCN(CC2)C)C)C3=CC4=CC(=CC(=C4C(=O)N3)OC)OC

InChI

InChI=1S/C26H33N3O4/c1-17-12-19(13-18(2)25(17)33-11-10-29-8-6-28(3)7-9-29)22-15-20-14-21(31-4)16-23(32-5)24(20)26(30)27-22/h12-16H,6-11H2,1-5H3,(H,27,30)