1-[4-[(6-cyclohexyloxy-5-nitro-pyrimidin-4-yl)amino]phenyl]ethanone

Systemtic Name: 1-[4-[(6-cyclohexyloxy-5-nitro-pyrimidin-4-yl)amino]phenyl]ethanone Openeye Name: 1-[4-[[6-(cyclohexoxy)-5-nitro-pyrimidin-4-yl]amino]phenyl]ethanone CAS Name: 1-[4-[(6-cyclohexyloxy-5-nitro-4-pyrimidinyl)amino]phenyl]ethanone IUPAC Name: 1-[4-[(6-cyclohexyloxy-5-nitropyrimidin-4-yl)amino]phenyl]ethanone Traditional Name: 1-[4-[[6-(cyclohexoxy)-5-nitro-pyrimidin-4-yl]amino]phenyl]ethanone Formula: C18H20N4O4 MolecularWeight: 356.3758

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)NC2=C(C(=NC=N2)OC3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)NC2=C(C(=NC=N2)OC3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C18H20N4O4/c1-12(23)13-7-9-14(10-8-13)21-17-16(22(24)25)18(20-11-19-17)26-15-5-3-2-4-6-15/h7-11,15H,2-6H2,1H3,(H,19,20,21)