N-(4-methoxyphenyl)-6-methyl-2-(4-methylpiperidin-1-yl)-5-nitro-pyrimidin-4-amine

Systemtic Name: N-(4-methoxyphenyl)-6-methyl-2-(4-methylpiperidin-1-yl)-5-nitro-pyrimidin-4-amine Openeye Name: N-(4-methoxyphenyl)-6-methyl-2-(4-methyl-1-piperidyl)-5-nitro-pyrimidin-4-amine CAS Name: N-(4-methoxyphenyl)-6-methyl-2-(4-methyl-1-piperidinyl)-5-nitro-4-pyrimidinamine IUPAC Name: N-(4-methoxyphenyl)-6-methyl-2-(4-methylpiperidin-1-yl)-5-nitropyrimidin-4-amine Traditional Name: (4-methoxyphenyl)-[6-methyl-2-(4-methylpiperidino)-5-nitro-pyrimidin-4-yl]amine Formula: C18H23N5O3 MolecularWeight: 357.40692

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=NC(=C(C(=N2)NC3=CC=C(C=C3)OC)[N+](=O)[O-])C

Isomeric SMILES

CC1CCN(CC1)C2=NC(=C(C(=N2)NC3=CC=C(C=C3)OC)[N+](=O)[O-])C

InChI

InChI=1S/C18H23N5O3/c1-12-8-10-22(11-9-12)18-19-13(2)16(23(24)25)17(21-18)20-14-4-6-15(26-3)7-5-14/h4-7,12H,8-11H2,1-3H3,(H,19,20,21)