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

Systemtic Name: 2-methyl-5-nitro-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-1H-pyrimidin-4-one Openeye Name: 2-methyl-5-nitro-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-1H-pyrimidin-4-one CAS Name: 2-methyl-5-nitro-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-1H-pyrimidin-4-one IUPAC Name: 2-methyl-5-nitro-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-1H-pyrimidin-4-one Traditional Name: 2-methyl-5-nitro-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-1H-pyrimidin-4-one Formula: C15H16N4O3 MolecularWeight: 300.31254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)C(=C(N1)N2CCC3=CC=CC=C3CC2)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=O)C(=C(N1)N2CCC3=CC=CC=C3CC2)[N+](=O)[O-]

InChI

InChI=1S/C15H16N4O3/c1-10-16-14(13(19(21)22)15(20)17-10)18-8-6-11-4-2-3-5-12(11)7-9-18/h2-5H,6-9H2,1H3,(H,16,17,20)