N-[(S)-(4-fluorophenyl)-(2-methyl-1H-indol-3-yl)methyl]pyridin-1-ium-2-amine

Systemtic Name: N-[(S)-(4-fluorophenyl)-(2-methyl-1H-indol-3-yl)methyl]pyridin-1-ium-2-amine Openeye Name: N-[(S)-(4-fluorophenyl)-(2-methyl-1H-indol-3-yl)methyl]pyridin-1-ium-2-amine CAS Name: N-[(S)-(4-fluorophenyl)-(2-methyl-1H-indol-3-yl)methyl]-2-pyridin-1-iumamine IUPAC Name: N-[(S)-(4-fluorophenyl)-(2-methyl-1H-indol-3-yl)methyl]pyridin-1-ium-2-amine Traditional Name: [(S)-(4-fluorophenyl)-(2-methyl-1H-indol-3-yl)methyl]-pyridin-1-ium-2-yl-amine Formula: C21H19FN3+ MolecularWeight: 332.394063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(C3=CC=C(C=C3)F)NC4=CC=CC=[NH+]4

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)[C@H](C3=CC=C(C=C3)F)NC4=CC=CC=[NH+]4

InChI

InChI=1S/C21H18FN3/c1-14-20(17-6-2-3-7-18(17)24-14)21(15-9-11-16(22)12-10-15)25-19-8-4-5-13-23-19/h2-13,21,24H,1H3,(H,23,25)/p+1/t21-/m0/s1