2-methyl-1-[[5-nitro-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidin-4-yl]amino]propan-1-ol

Systemtic Name: 2-methyl-1-[[5-nitro-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidin-4-yl]amino]propan-1-ol Openeye Name: 2-methyl-1-[[5-nitro-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidin-4-yl]amino]propan-1-ol CAS Name: 2-methyl-1-[[5-nitro-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-4-pyrimidinyl]amino]-1-propanol IUPAC Name: 2-methyl-1-[[5-nitro-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidin-4-yl]amino]propan-1-ol Traditional Name: 2-methyl-1-[[5-nitro-6-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pyrimidin-4-yl]amino]propan-1-ol Formula: C18H23N5O3 MolecularWeight: 357.40692

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(NC1=NC=NC(=C1[N+](=O)[O-])N2CCC3=CC=CC=C3CC2)O

Isomeric SMILES

CC(C)C(NC1=NC=NC(=C1[N+](=O)[O-])N2CCC3=CC=CC=C3CC2)O

InChI

InChI=1S/C18H23N5O3/c1-12(2)18(24)21-16-15(23(25)26)17(20-11-19-16)22-9-7-13-5-3-4-6-14(13)8-10-22/h3-6,11-12,18,24H,7-10H2,1-2H3,(H,19,20,21)