1-(4-chlorophenyl)-5-[(1R)-2-ethanoyl-3,4-dihydro-1H-isoquinolin-1-yl]-6-oxidanyl-pyrimidine-2,4-dione

Systemtic Name: 1-(4-chlorophenyl)-5-[(1R)-2-ethanoyl-3,4-dihydro-1H-isoquinolin-1-yl]-6-oxidanyl-pyrimidine-2,4-dione Openeye Name: 5-[(1R)-2-acetyl-3,4-dihydro-1H-isoquinolin-1-yl]-1-(4-chlorophenyl)-6-hydroxy-pyrimidine-2,4-dione CAS Name: 5-[(1R)-2-acetyl-3,4-dihydro-1H-isoquinolin-1-yl]-1-(4-chlorophenyl)-6-hydroxypyrimidine-2,4-dione IUPAC Name: 5-[(1R)-2-acetyl-3,4-dihydro-1H-isoquinolin-1-yl]-1-(4-chlorophenyl)-6-hydroxypyrimidine-2,4-dione Traditional Name: 5-[(1R)-2-acetyl-3,4-dihydro-1H-isoquinolin-1-yl]-1-(4-chlorophenyl)-6-hydroxy-pyrimidine-2,4-quinone Formula: C21H18ClN3O4 MolecularWeight: 411.83832

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC2=CC=CC=C2C1C3=C(N(C(=O)NC3=O)C4=CC=C(C=C4)Cl)O

Isomeric SMILES

CC(=O)N1CCC2=CC=CC=C2[C@@H]1C3=C(N(C(=O)NC3=O)C4=CC=C(C=C4)Cl)O

InChI

InChI=1S/C21H18ClN3O4/c1-12(26)24-11-10-13-4-2-3-5-16(13)18(24)17-19(27)23-21(29)25(20(17)28)15-8-6-14(22)7-9-15/h2-9,18,28H,10-11H2,1H3,(H,23,27,29)/t18-/m1/s1