3,4-dihydro-1H-isoquinolin-2-yl-(4-morpholin-4-yl-3-nitro-phenyl)methanone

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-(4-morpholin-4-yl-3-nitro-phenyl)methanone Openeye Name: 3,4-dihydro-1H-isoquinolin-2-yl-(4-morpholino-3-nitro-phenyl)methanone CAS Name: 3,4-dihydro-1H-isoquinolin-2-yl-[4-(4-morpholinyl)-3-nitrophenyl]methanone IUPAC Name: 3,4-dihydro-1H-isoquinolin-2-yl-(4-morpholin-4-yl-3-nitrophenyl)methanone Traditional Name: 3,4-dihydro-1H-isoquinolin-2-yl-(4-morpholino-3-nitro-phenyl)methanone Formula: C20H21N3O4 MolecularWeight: 367.39844

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C20H21N3O4/c24-20(22-8-7-15-3-1-2-4-17(15)14-22)16-5-6-18(19(13-16)23(25)26)21-9-11-27-12-10-21/h1-6,13H,7-12,14H2