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

Systemtic Name: 4-[2-(3-chloranylpyridin-2-yl)-4,6-bis(trifluoromethyl)-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[2-(3-chloro-2-pyridyl)-4,6-bis(trifluoromethyl)-1H-indol-3-yl]butan-1-amine CAS Name: 4-[2-(3-chloro-2-pyridinyl)-4,6-bis(trifluoromethyl)-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[2-(3-chloropyridin-2-yl)-4,6-bis(trifluoromethyl)-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[2-(3-chloro-2-pyridyl)-4,6-bis(trifluoromethyl)-1H-indol-3-yl]butylamine Formula: C19H16ClF6N3 MolecularWeight: 435.793859

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)C2=C(C3=C(C=C(C=C3N2)C(F)(F)F)C(F)(F)F)CCCCN)Cl

Isomeric SMILES

C1=CC(=C(N=C1)C2=C(C3=C(C=C(C=C3N2)C(F)(F)F)C(F)(F)F)CCCCN)Cl

InChI

InChI=1S/C19H16ClF6N3/c20-13-5-3-7-28-17(13)16-11(4-1-2-6-27)15-12(19(24,25)26)8-10(18(21,22)23)9-14(15)29-16/h3,5,7-9,29H,1-2,4,6,27H2