3-[2-(2-azanylethyl)-1H-indol-3-yl]-3-(1H-indol-3-yl)-2-oxidanylidene-1H-imidazol-3-ium-5-carbonitrile

Systemtic Name: 3-[2-(2-azanylethyl)-1H-indol-3-yl]-3-(1H-indol-3-yl)-2-oxidanylidene-1H-imidazol-3-ium-5-carbonitrile Openeye Name: 3-[2-(2-aminoethyl)-1H-indol-3-yl]-3-(1H-indol-3-yl)-2-oxo-1H-imidazol-3-ium-5-carbonitrile CAS Name: 3-[2-(2-aminoethyl)-1H-indol-3-yl]-3-(1H-indol-3-yl)-2-oxo-1H-imidazol-3-ium-5-carbonitrile IUPAC Name: 3-[2-(2-aminoethyl)-1H-indol-3-yl]-3-(1H-indol-3-yl)-2-oxo-1H-imidazol-3-ium-5-carbonitrile Traditional Name: 1-[2-(2-aminoethyl)-1H-indol-3-yl]-1-(1H-indol-3-yl)-2-keto-4-imidazolin-1-ium-4-carbonitrile Formula: C22H19N6O+ MolecularWeight: 383.42586

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)[N+]3(C=C(NC3=O)C#N)C4=C(NC5=CC=CC=C54)CCN

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)[N+]3(C=C(NC3=O)C#N)C4=C(NC5=CC=CC=C54)CCN

InChI

InChI=1S/C22H18N6O/c23-10-9-19-21(16-6-2-4-8-18(16)27-19)28(13-14(11-24)26-22(28)29)20-12-25-17-7-3-1-5-15(17)20/h1-8,12-13,25,27H,9-10,23H2/p+1