4-[2-(6-methoxypyridin-2-yl)-4,6-bis(trifluoromethyl)-1H-indol-3-yl]butan-1-amine

Systemtic Name: 4-[2-(6-methoxypyridin-2-yl)-4,6-bis(trifluoromethyl)-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[2-(6-methoxy-2-pyridyl)-4,6-bis(trifluoromethyl)-1H-indol-3-yl]butan-1-amine CAS Name: 4-[2-(6-methoxy-2-pyridinyl)-4,6-bis(trifluoromethyl)-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[2-(6-methoxypyridin-2-yl)-4,6-bis(trifluoromethyl)-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[2-(6-methoxy-2-pyridyl)-4,6-bis(trifluoromethyl)-1H-indol-3-yl]butylamine Formula: C20H19F6N3O MolecularWeight: 431.374779

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=N1)C2=C(C3=C(C=C(C=C3N2)C(F)(F)F)C(F)(F)F)CCCCN

Isomeric SMILES

COC1=CC=CC(=N1)C2=C(C3=C(C=C(C=C3N2)C(F)(F)F)C(F)(F)F)CCCCN

InChI

InChI=1S/C20H19F6N3O/c1-30-16-7-4-6-14(28-16)18-12(5-2-3-8-27)17-13(20(24,25)26)9-11(19(21,22)23)10-15(17)29-18/h4,6-7,9-10,29H,2-3,5,8,27H2,1H3