(6,7-dimethoxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-(3,5-dinitrophenyl)methanone

Systemtic Name: (6,7-dimethoxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-(3,5-dinitrophenyl)methanone Openeye Name: (6,7-dimethoxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-(3,5-dinitrophenyl)methanone CAS Name: (6,7-dimethoxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-(3,5-dinitrophenyl)methanone IUPAC Name: (6,7-dimethoxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-(3,5-dinitrophenyl)methanone Traditional Name: (6,7-dimethoxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-(3,5-dinitrophenyl)methanone Formula: C19H19N3O7 MolecularWeight: 401.37006

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CC(=C(C=C2CCN1C(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])OC)OC

Isomeric SMILES

CC1C2=CC(=C(C=C2CCN1C(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])OC)OC

InChI

InChI=1S/C19H19N3O7/c1-11-16-10-18(29-3)17(28-2)8-12(16)4-5-20(11)19(23)13-6-14(21(24)25)9-15(7-13)22(26)27/h6-11H,4-5H2,1-3H3