N-(3-methoxyphenyl)-5-nitro-6-piperidin-1-yl-pyrimidin-4-amine

Systemtic Name: N-(3-methoxyphenyl)-5-nitro-6-piperidin-1-yl-pyrimidin-4-amine Openeye Name: N-(3-methoxyphenyl)-5-nitro-6-(1-piperidyl)pyrimidin-4-amine CAS Name: N-(3-methoxyphenyl)-5-nitro-6-(1-piperidinyl)-4-pyrimidinamine IUPAC Name: N-(3-methoxyphenyl)-5-nitro-6-piperidin-1-ylpyrimidin-4-amine Traditional Name: (3-methoxyphenyl)-(5-nitro-6-piperidino-pyrimidin-4-yl)amine Formula: C16H19N5O3 MolecularWeight: 329.35376

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC2=NC=NC(=C2[N+](=O)[O-])N3CCCCC3

Isomeric SMILES

COC1=CC=CC(=C1)NC2=NC=NC(=C2[N+](=O)[O-])N3CCCCC3

InChI

InChI=1S/C16H19N5O3/c1-24-13-7-5-6-12(10-13)19-15-14(21(22)23)16(18-11-17-15)20-8-3-2-4-9-20/h5-7,10-11H,2-4,8-9H2,1H3,(H,17,18,19)