1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-[4-(4,6-dimethoxypyrimidin-2-yl)piperidin-1-yl]butane-1,4-dione

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-[4-(4,6-dimethoxypyrimidin-2-yl)piperidin-1-yl]butane-1,4-dione Openeye Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-[4-(4,6-dimethoxypyrimidin-2-yl)-1-piperidyl]butane-1,4-dione CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-[4-(4,6-dimethoxy-2-pyrimidinyl)-1-piperidinyl]butane-1,4-dione IUPAC Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-[4-(4,6-dimethoxypyrimidin-2-yl)piperidin-1-yl]butane-1,4-dione Traditional Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-[4-(4,6-dimethoxypyrimidin-2-yl)piperidino]butane-1,4-dione Formula: C24H30N4O4 MolecularWeight: 438.5194

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)C2CCN(CC2)C(=O)CCC(=O)N3CCC4=CC=CC=C4C3)OC

Isomeric SMILES

COC1=CC(=NC(=N1)C2CCN(CC2)C(=O)CCC(=O)N3CCC4=CC=CC=C4C3)OC

InChI

InChI=1S/C24H30N4O4/c1-31-20-15-21(32-2)26-24(25-20)18-10-12-27(13-11-18)22(29)7-8-23(30)28-14-9-17-5-3-4-6-19(17)16-28/h3-6,15,18H,7-14,16H2,1-2H3