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

Systemtic Name: N-[(S)-(2-methyl-1H-indol-3-yl)-pyridin-4-yl-methyl]pyridin-1-ium-2-amine Openeye Name: N-[(S)-(2-methyl-1H-indol-3-yl)-(4-pyridyl)methyl]pyridin-1-ium-2-amine CAS Name: N-[(S)-(2-methyl-1H-indol-3-yl)-pyridin-4-ylmethyl]-2-pyridin-1-iumamine IUPAC Name: N-[(S)-(2-methyl-1H-indol-3-yl)-pyridin-4-ylmethyl]pyridin-1-ium-2-amine Traditional Name: [(S)-(2-methyl-1H-indol-3-yl)-(4-pyridyl)methyl]-pyridin-1-ium-2-yl-amine Formula: C20H19N4+ MolecularWeight: 315.39166

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18N4/c1-14-19(16-6-2-3-7-17(16)23-14)20(15-9-12-21-13-10-15)24-18-8-4-5-11-22-18/h2-13,20,23H,1H3,(H,22,24)/p+1/t20-/m0/s1