6-(7,8-dimethoxy-1,2,4,5-tetrahydro-3-benzazepin-3-yl)-2-methyl-5-nitro-1H-pyrimidin-4-one

Systemtic Name: 6-(7,8-dimethoxy-1,2,4,5-tetrahydro-3-benzazepin-3-yl)-2-methyl-5-nitro-1H-pyrimidin-4-one Openeye Name: 6-(7,8-dimethoxy-1,2,4,5-tetrahydro-3-benzazepin-3-yl)-2-methyl-5-nitro-1H-pyrimidin-4-one CAS Name: 6-(7,8-dimethoxy-1,2,4,5-tetrahydro-3-benzazepin-3-yl)-2-methyl-5-nitro-1H-pyrimidin-4-one IUPAC Name: 6-(7,8-dimethoxy-1,2,4,5-tetrahydro-3-benzazepin-3-yl)-2-methyl-5-nitro-1H-pyrimidin-4-one Traditional Name: 6-(7,8-dimethoxy-1,2,4,5-tetrahydro-3-benzazepin-3-yl)-2-methyl-5-nitro-1H-pyrimidin-4-one Formula: C17H20N4O5 MolecularWeight: 360.3645

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N4O5/c1-10-18-16(15(21(23)24)17(22)19-10)20-6-4-11-8-13(25-2)14(26-3)9-12(11)5-7-20/h8-9H,4-7H2,1-3H3,(H,18,19,22)