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

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(2-nitropyridin-3-yl)oxy-ethanone Openeye Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(2-nitro-3-pyridyl)oxy]ethanone CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(2-nitro-3-pyridinyl)oxy]ethanone IUPAC Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(2-nitropyridin-3-yl)oxyethanone Traditional Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(2-nitro-3-pyridyl)oxy]ethanone Formula: C16H15N3O4 MolecularWeight: 313.308

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)COC3=C(N=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)COC3=C(N=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H15N3O4/c20-15(11-23-14-6-3-8-17-16(14)19(21)22)18-9-7-12-4-1-2-5-13(12)10-18/h1-6,8H,7,9-11H2