5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-oxidanyl-1-phenyl-pyrimidine-2,4-dione

Systemtic Name: 5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-oxidanyl-1-phenyl-pyrimidine-2,4-dione Openeye Name: 5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-1-phenyl-pyrimidine-2,4-dione CAS Name: 5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-1-phenylpyrimidine-2,4-dione IUPAC Name: 5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-1-phenylpyrimidine-2,4-dione Traditional Name: 5-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-1-phenyl-pyrimidine-2,4-quinone Formula: C21H21N3O5 MolecularWeight: 395.40854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(NCCC2=C1)C3=C(N(C(=O)NC3=O)C4=CC=CC=C4)O)OC

Isomeric SMILES

COC1=C(C=C2C(NCCC2=C1)C3=C(N(C(=O)NC3=O)C4=CC=CC=C4)O)OC

InChI

InChI=1S/C21H21N3O5/c1-28-15-10-12-8-9-22-18(14(12)11-16(15)29-2)17-19(25)23-21(27)24(20(17)26)13-6-4-3-5-7-13/h3-7,10-11,18,22,26H,8-9H2,1-2H3,(H,23,25,27)