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

Systemtic Name: 4-methyl-N-[(S)-(2-methyl-1H-indol-3-yl)-pyridin-2-yl-methyl]pyridin-1-ium-2-amine Openeye Name: 4-methyl-N-[(S)-(2-methyl-1H-indol-3-yl)-(2-pyridyl)methyl]pyridin-1-ium-2-amine CAS Name: 4-methyl-N-[(S)-(2-methyl-1H-indol-3-yl)-(2-pyridinyl)methyl]-2-pyridin-1-iumamine IUPAC Name: 4-methyl-N-[(S)-(2-methyl-1H-indol-3-yl)-pyridin-2-ylmethyl]pyridin-1-ium-2-amine Traditional Name: [(S)-(2-methyl-1H-indol-3-yl)-(2-pyridyl)methyl]-(4-methylpyridin-1-ium-2-yl)amine Formula: C21H21N4+ MolecularWeight: 329.41824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C=C1)NC(C2=CC=CC=N2)C3=C(NC4=CC=CC=C43)C

Isomeric SMILES

CC1=CC(=[NH+]C=C1)N[C@H](C2=CC=CC=N2)C3=C(NC4=CC=CC=C43)C

InChI

InChI=1S/C21H20N4/c1-14-10-12-23-19(13-14)25-21(18-9-5-6-11-22-18)20-15(2)24-17-8-4-3-7-16(17)20/h3-13,21,24H,1-2H3,(H,23,25)/p+1/t21-/m1/s1