1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(6-methyl-2-nitro-pyridin-3-yl)oxy-ethanone

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(6-methyl-2-nitro-pyridin-3-yl)oxy-ethanone Openeye Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(6-methyl-2-nitro-3-pyridyl)oxy]ethanone CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(6-methyl-2-nitro-3-pyridinyl)oxy]ethanone IUPAC Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(6-methyl-2-nitropyridin-3-yl)oxyethanone Traditional Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(6-methyl-2-nitro-3-pyridyl)oxy]ethanone Formula: C17H17N3O4 MolecularWeight: 327.33458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)OCC(=O)N2CCC3=CC=CC=C3C2)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=C(C=C1)OCC(=O)N2CCC3=CC=CC=C3C2)[N+](=O)[O-]

InChI

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