4-[2-chloranyl-4-(trifluoromethyl)phenyl]-N-(1-methoxybutan-2-yl)-3-nitro-pyridin-2-amine

Systemtic Name: 4-[2-chloranyl-4-(trifluoromethyl)phenyl]-N-(1-methoxybutan-2-yl)-3-nitro-pyridin-2-amine Openeye Name: 4-[2-chloro-4-(trifluoromethyl)phenyl]-N-[1-(methoxymethyl)propyl]-3-nitro-pyridin-2-amine CAS Name: 4-[2-chloro-4-(trifluoromethyl)phenyl]-N-(1-methoxybutan-2-yl)-3-nitro-2-pyridinamine IUPAC Name: 4-[2-chloro-4-(trifluoromethyl)phenyl]-N-(1-methoxybutan-2-yl)-3-nitropyridin-2-amine Traditional Name: [4-[2-chloro-4-(trifluoromethyl)phenyl]-3-nitro-2-pyridyl]-[1-(methoxymethyl)propyl]amine Formula: C17H17ClF3N3O3 MolecularWeight: 403.78339

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Descriptors Computed from Structure

Canonical SMILES:

CCC(COC)NC1=NC=CC(=C1[N+](=O)[O-])C2=C(C=C(C=C2)C(F)(F)F)Cl

Isomeric SMILES

CCC(COC)NC1=NC=CC(=C1[N+](=O)[O-])C2=C(C=C(C=C2)C(F)(F)F)Cl

InChI

InChI=1S/C17H17ClF3N3O3/c1-3-11(9-27-2)23-16-15(24(25)26)13(6-7-22-16)12-5-4-10(8-14(12)18)17(19,20)21/h4-8,11H,3,9H2,1-2H3,(H,22,23)