3-(2-methyl-5-nitro-4-oxidanylidene-1H-pyrimidin-6-yl)-2,4-dihydro-1H-3-benzazepin-5-one

Systemtic Name: 3-(2-methyl-5-nitro-4-oxidanylidene-1H-pyrimidin-6-yl)-2,4-dihydro-1H-3-benzazepin-5-one Openeye Name: 3-(2-methyl-5-nitro-4-oxo-1H-pyrimidin-6-yl)-2,4-dihydro-1H-3-benzazepin-5-one CAS Name: 3-(2-methyl-5-nitro-4-oxo-1H-pyrimidin-6-yl)-2,4-dihydro-1H-3-benzazepin-5-one IUPAC Name: 3-(2-methyl-5-nitro-4-oxo-1H-pyrimidin-6-yl)-2,4-dihydro-1H-3-benzazepin-5-one Traditional Name: 3-(4-keto-2-methyl-5-nitro-1H-pyrimidin-6-yl)-2,4-dihydro-1H-3-benzazepin-5-one Formula: C15H14N4O4 MolecularWeight: 314.29606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)C(=C(N1)N2CCC3=CC=CC=C3C(=O)C2)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=O)C(=C(N1)N2CCC3=CC=CC=C3C(=O)C2)[N+](=O)[O-]

InChI

InChI=1S/C15H14N4O4/c1-9-16-14(13(19(22)23)15(21)17-9)18-7-6-10-4-2-3-5-11(10)12(20)8-18/h2-5H,6-8H2,1H3,(H,16,17,21)