N-[(4-methoxyphenyl)methyl]-5-nitro-6-piperidin-1-yl-pyrimidin-4-amine

Systemtic Name: N-[(4-methoxyphenyl)methyl]-5-nitro-6-piperidin-1-yl-pyrimidin-4-amine Openeye Name: N-[(4-methoxyphenyl)methyl]-5-nitro-6-(1-piperidyl)pyrimidin-4-amine CAS Name: N-[(4-methoxyphenyl)methyl]-5-nitro-6-(1-piperidinyl)-4-pyrimidinamine IUPAC Name: N-[(4-methoxyphenyl)methyl]-5-nitro-6-piperidin-1-ylpyrimidin-4-amine Traditional Name: (5-nitro-6-piperidino-pyrimidin-4-yl)-p-anisyl-amine Formula: C17H21N5O3 MolecularWeight: 343.38034

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC2=NC=NC(=C2[N+](=O)[O-])N3CCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)CNC2=NC=NC(=C2[N+](=O)[O-])N3CCCCC3

InChI

InChI=1S/C17H21N5O3/c1-25-14-7-5-13(6-8-14)11-18-16-15(22(23)24)17(20-12-19-16)21-9-3-2-4-10-21/h5-8,12H,2-4,9-11H2,1H3,(H,18,19,20)