N-[(E)-(2,4-dimethyl-1,2,4-triazol-3-ylidene)amino]-1-methyl-indol-1-ium-3-imine

Systemtic Name: N-[(E)-(2,4-dimethyl-1,2,4-triazol-3-ylidene)amino]-1-methyl-indol-1-ium-3-imine Openeye Name: N-[(E)-(2,4-dimethyl-1,2,4-triazol-3-ylidene)amino]-1-methyl-indol-1-ium-3-imine CAS Name: N-[(E)-(2,4-dimethyl-1,2,4-triazol-3-ylidene)amino]-1-methyl-3-indol-1-iumimine IUPAC Name: N-[(E)-(2,4-dimethyl-1,2,4-triazol-3-ylidene)amino]-1-methylindol-1-ium-3-imine Traditional Name: (E)-(2,4-dimethyl-1,2,4-triazol-3-ylidene)-[(Z)-(1-methylindol-1-ium-3-ylidene)amino]amine Formula: C13H15N6+ MolecularWeight: 255.2984

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN(C1=NN=C2C=[N+](C3=CC=CC=C32)C)C

Isomeric SMILES

CN\1C=NN(/C1=N/N=C/2\C=[N+](C3=CC=CC=C32)C)C

InChI

InChI=1S/C13H15N6/c1-17-8-11(10-6-4-5-7-12(10)17)15-16-13-18(2)9-14-19(13)3/h4-9H,1-3H3/q+1