3-chloranyl-N-[2-(1H-indol-3-yl)ethyl]-5-(trifluoromethyl)pyridin-1-ium-2-amine

Systemtic Name: 3-chloranyl-N-[2-(1H-indol-3-yl)ethyl]-5-(trifluoromethyl)pyridin-1-ium-2-amine Openeye Name: 3-chloro-N-[2-(1H-indol-3-yl)ethyl]-5-(trifluoromethyl)pyridin-1-ium-2-amine CAS Name: 3-chloro-N-[2-(1H-indol-3-yl)ethyl]-5-(trifluoromethyl)-2-pyridin-1-iumamine IUPAC Name: 3-chloro-N-[2-(1H-indol-3-yl)ethyl]-5-(trifluoromethyl)pyridin-1-ium-2-amine Traditional Name: [3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]-[2-(1H-indol-3-yl)ethyl]amine Formula: C16H14ClF3N3+ MolecularWeight: 340.75067

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CCNC3=C(C=C(C=[NH+]3)C(F)(F)F)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CCNC3=C(C=C(C=[NH+]3)C(F)(F)F)Cl

InChI

InChI=1S/C16H13ClF3N3/c17-13-7-11(16(18,19)20)9-23-15(13)21-6-5-10-8-22-14-4-2-1-3-12(10)14/h1-4,7-9,22H,5-6H2,(H,21,23)/p+1