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

Systemtic Name: 4-[2-(6-methoxypyridin-3-yl)-4,6-bis(trifluoromethyl)-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[2-(6-methoxy-3-pyridyl)-4,6-bis(trifluoromethyl)-1H-indol-3-yl]butan-1-amine CAS Name: 4-[2-(6-methoxy-3-pyridinyl)-4,6-bis(trifluoromethyl)-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[2-(6-methoxypyridin-3-yl)-4,6-bis(trifluoromethyl)-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[2-(6-methoxy-3-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=NC=C(C=C1)C2=C(C3=C(C=C(C=C3N2)C(F)(F)F)C(F)(F)F)CCCCN

Isomeric SMILES

COC1=NC=C(C=C1)C2=C(C3=C(C=C(C=C3N2)C(F)(F)F)C(F)(F)F)CCCCN

InChI

InChI=1S/C20H19F6N3O/c1-30-16-6-5-11(10-28-16)18-13(4-2-3-7-27)17-14(20(24,25)26)8-12(19(21,22)23)9-15(17)29-18/h5-6,8-10,29H,2-4,7,27H2,1H3