N-butyl-5-methoxy-2-(trifluoromethyl)-1,10-phenanthrolin-4-amine

Systemtic Name: N-butyl-5-methoxy-2-(trifluoromethyl)-1,10-phenanthrolin-4-amine Openeye Name: N-butyl-5-methoxy-2-(trifluoromethyl)-1,10-phenanthrolin-4-amine CAS Name: N-butyl-5-methoxy-2-(trifluoromethyl)-1,10-phenanthrolin-4-amine IUPAC Name: N-butyl-5-methoxy-2-(trifluoromethyl)-1,10-phenanthrolin-4-amine Traditional Name: butyl-[5-methoxy-2-(trifluoromethyl)-1,10-phenanthrolin-4-yl]amine Formula: C18H18F3N3O MolecularWeight: 349.35023

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=CC(=NC2=C3C(=CC(=C12)OC)C=CC=N3)C(F)(F)F

Isomeric SMILES

CCCCNC1=CC(=NC2=C3C(=CC(=C12)OC)C=CC=N3)C(F)(F)F

InChI

InChI=1S/C18H18F3N3O/c1-3-4-7-22-12-10-14(18(19,20)21)24-17-15(12)13(25-2)9-11-6-5-8-23-16(11)17/h5-6,8-10H,3-4,7H2,1-2H3,(H,22,24)