N-[2-(4-butyl-2-methyl-phenoxy)ethyl]-5-chloranyl-6-methyl-pyrimidin-4-amine nitrate

Systemtic Name: N-[2-(4-butyl-2-methyl-phenoxy)ethyl]-5-chloranyl-6-methyl-pyrimidin-4-amine nitrate Openeye Name: N-[2-(4-butyl-2-methyl-phenoxy)ethyl]-5-chloro-6-methyl-pyrimidin-4-amine nitrate CAS Name: N-[2-(4-butyl-2-methylphenoxy)ethyl]-5-chloro-6-methyl-4-pyrimidinamine nitrate IUPAC Name: N-[2-(4-butyl-2-methylphenoxy)ethyl]-5-chloro-6-methylpyrimidin-4-amine nitrate Traditional Name: 2-(4-butyl-2-methyl-phenoxy)ethyl-(5-chloro-6-methyl-pyrimidin-4-yl)amine nitrate Formula: C18H24ClN4O4- MolecularWeight: 395.86056

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C(C=C1)OCCNC2=NC=NC(=C2Cl)C)C.[N+](=O)([O-])[O-]

Isomeric SMILES

CCCCC1=CC(=C(C=C1)OCCNC2=NC=NC(=C2Cl)C)C.[N+](=O)([O-])[O-]

InChI

InChI=1S/C18H24ClN3O.NO3/c1-4-5-6-15-7-8-16(13(2)11-15)23-10-9-20-18-17(19)14(3)21-12-22-18;2-1(3)4/h7-8,11-12H,4-6,9-10H2,1-3H3,(H,20,21,22);/q;-1