1-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(3,4-dihydro-1H-isoquinolin-2-yl)butane-1,4-dione

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(3,4-dihydro-1H-isoquinolin-2-yl)butane-1,4-dione Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(3,4-dihydro-1H-isoquinolin-2-yl)butane-1,4-dione CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(3,4-dihydro-1H-isoquinolin-2-yl)butane-1,4-dione IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(3,4-dihydro-1H-isoquinolin-2-yl)butane-1,4-dione Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(3,4-dihydro-1H-isoquinolin-2-yl)butane-1,4-dione Formula: C21H21NO4 MolecularWeight: 351.39574

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)CCC(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)CCC(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C21H21NO4/c23-18(16-5-7-19-20(13-16)26-12-11-25-19)6-8-21(24)22-10-9-15-3-1-2-4-17(15)14-22/h1-5,7,13H,6,8-12,14H2