N-[2-(2-methyl-1H-indol-3-yl)ethyl]-5-nitro-pyridin-1-ium-2-amine

Systemtic Name: N-[2-(2-methyl-1H-indol-3-yl)ethyl]-5-nitro-pyridin-1-ium-2-amine Openeye Name: N-[2-(2-methyl-1H-indol-3-yl)ethyl]-5-nitro-pyridin-1-ium-2-amine CAS Name: N-[2-(2-methyl-1H-indol-3-yl)ethyl]-5-nitro-2-pyridin-1-iumamine IUPAC Name: N-[2-(2-methyl-1H-indol-3-yl)ethyl]-5-nitropyridin-1-ium-2-amine Traditional Name: 2-(2-methyl-1H-indol-3-yl)ethyl-(5-nitropyridin-1-ium-2-yl)amine Formula: C16H17N4O2+ MolecularWeight: 297.33178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)CCNC3=[NH+]C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)CCNC3=[NH+]C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H16N4O2/c1-11-13(14-4-2-3-5-15(14)19-11)8-9-17-16-7-6-12(10-18-16)20(21)22/h2-7,10,19H,8-9H2,1H3,(H,17,18)/p+1