4-[(5-nitro-4-phenylazanyl-pyrimidin-2-yl)amino]cyclohexan-1-ol

Systemtic Name: 4-[(5-nitro-4-phenylazanyl-pyrimidin-2-yl)amino]cyclohexan-1-ol Openeye Name: 4-[(4-anilino-5-nitro-pyrimidin-2-yl)amino]cyclohexanol CAS Name: 4-[(4-anilino-5-nitro-2-pyrimidinyl)amino]-1-cyclohexanol IUPAC Name: 4-[(4-anilino-5-nitropyrimidin-2-yl)amino]cyclohexan-1-ol Traditional Name: 4-[(4-anilino-5-nitro-pyrimidin-2-yl)amino]cyclohexanol Formula: C16H19N5O3 MolecularWeight: 329.35376

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1NC2=NC=C(C(=N2)NC3=CC=CC=C3)[N+](=O)[O-])O

Isomeric SMILES

C1CC(CCC1NC2=NC=C(C(=N2)NC3=CC=CC=C3)[N+](=O)[O-])O

InChI

InChI=1S/C16H19N5O3/c22-13-8-6-12(7-9-13)19-16-17-10-14(21(23)24)15(20-16)18-11-4-2-1-3-5-11/h1-5,10,12-13,22H,6-9H2,(H2,17,18,19,20)