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

Systemtic Name: N-[(S)-(2-methoxyphenyl)-(2-methyl-1H-indol-3-yl)methyl]pyridin-1-ium-2-amine Openeye Name: N-[(S)-(2-methoxyphenyl)-(2-methyl-1H-indol-3-yl)methyl]pyridin-1-ium-2-amine CAS Name: N-[(S)-(2-methoxyphenyl)-(2-methyl-1H-indol-3-yl)methyl]-2-pyridin-1-iumamine IUPAC Name: N-[(S)-(2-methoxyphenyl)-(2-methyl-1H-indol-3-yl)methyl]pyridin-1-ium-2-amine Traditional Name: [(S)-(2-methoxyphenyl)-(2-methyl-1H-indol-3-yl)methyl]-pyridin-1-ium-2-yl-amine Formula: C22H22N3O+ MolecularWeight: 344.42958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(C3=CC=CC=C3OC)NC4=CC=CC=[NH+]4

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)[C@@H](C3=CC=CC=C3OC)NC4=CC=CC=[NH+]4

InChI

InChI=1S/C22H21N3O/c1-15-21(16-9-3-5-11-18(16)24-15)22(25-20-13-7-8-14-23-20)17-10-4-6-12-19(17)26-2/h3-14,22,24H,1-2H3,(H,23,25)/p+1/t22-/m1/s1