6-(4-chloranyl-3-methyl-phenoxy)-N-cycloheptyl-5-nitro-pyrimidin-4-amine

Systemtic Name: 6-(4-chloranyl-3-methyl-phenoxy)-N-cycloheptyl-5-nitro-pyrimidin-4-amine Openeye Name: 6-(4-chloro-3-methyl-phenoxy)-N-cycloheptyl-5-nitro-pyrimidin-4-amine CAS Name: 6-(4-chloro-3-methylphenoxy)-N-cycloheptyl-5-nitro-4-pyrimidinamine IUPAC Name: 6-(4-chloro-3-methylphenoxy)-N-cycloheptyl-5-nitropyrimidin-4-amine Traditional Name: [6-(4-chloro-3-methyl-phenoxy)-5-nitro-pyrimidin-4-yl]-cycloheptyl-amine Formula: C18H21ClN4O3 MolecularWeight: 376.83734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=NC=NC(=C2[N+](=O)[O-])NC3CCCCCC3)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=NC=NC(=C2[N+](=O)[O-])NC3CCCCCC3)Cl

InChI

InChI=1S/C18H21ClN4O3/c1-12-10-14(8-9-15(12)19)26-18-16(23(24)25)17(20-11-21-18)22-13-6-4-2-3-5-7-13/h8-11,13H,2-7H2,1H3,(H,20,21,22)