1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(2-nitropyridin-3-yl)oxy-propan-1-one

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(2-nitropyridin-3-yl)oxy-propan-1-one Openeye Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(2-nitro-3-pyridyl)oxy]propan-1-one CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(2-nitro-3-pyridinyl)oxy]-1-propanone IUPAC Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(2-nitropyridin-3-yl)oxypropan-1-one Traditional Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(2-nitro-3-pyridyl)oxy]propan-1-one Formula: C17H17N3O4 MolecularWeight: 327.33458

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC2=CC=CC=C2C1)OC3=C(N=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)N1CCC2=CC=CC=C2C1)OC3=C(N=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H17N3O4/c1-12(24-15-7-4-9-18-16(15)20(22)23)17(21)19-10-8-13-5-2-3-6-14(13)11-19/h2-7,9,12H,8,10-11H2,1H3