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

Systemtic Name: 4-methyl-N-[(R)-(2-methyl-1H-indol-3-yl)-(3-nitrophenyl)methyl]pyridin-1-ium-2-amine Openeye Name: 4-methyl-N-[(R)-(2-methyl-1H-indol-3-yl)-(3-nitrophenyl)methyl]pyridin-1-ium-2-amine CAS Name: 4-methyl-N-[(R)-(2-methyl-1H-indol-3-yl)-(3-nitrophenyl)methyl]-2-pyridin-1-iumamine IUPAC Name: 4-methyl-N-[(R)-(2-methyl-1H-indol-3-yl)-(3-nitrophenyl)methyl]pyridin-1-ium-2-amine Traditional Name: [(R)-(2-methyl-1H-indol-3-yl)-(3-nitrophenyl)methyl]-(4-methylpyridin-1-ium-2-yl)amine Formula: C22H21N4O2+ MolecularWeight: 373.42774

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H20N4O2/c1-14-10-11-23-20(12-14)25-22(16-6-5-7-17(13-16)26(27)28)21-15(2)24-19-9-4-3-8-18(19)21/h3-13,22,24H,1-2H3,(H,23,25)/p+1/t22-/m1/s1