1-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-8-oxidanyl-quinazoline-2,4-dione

Systemtic Name: 1-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-8-oxidanyl-quinazoline-2,4-dione Openeye Name: 1-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-8-hydroxy-quinazoline-2,4-dione CAS Name: 1-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-8-hydroxyquinazoline-2,4-dione IUPAC Name: 1-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-8-hydroxyquinazoline-2,4-dione Traditional Name: 1-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-8-hydroxy-quinazoline-2,4-quinone Formula: C20H21N3O3 MolecularWeight: 351.39904

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)CCCN3C4=C(C=CC=C4O)C(=O)NC3=O

Isomeric SMILES

C1CN(CC2=CC=CC=C21)CCCN3C4=C(C=CC=C4O)C(=O)NC3=O

InChI

InChI=1S/C20H21N3O3/c24-17-8-3-7-16-18(17)23(20(26)21-19(16)25)11-4-10-22-12-9-14-5-1-2-6-15(14)13-22/h1-3,5-8,24H,4,9-13H2,(H,21,25,26)