2-[2-[2-(benzotriazol-1-yl)ethanoylamino]benzimidazol-1-yl]ethyl-diethyl-azanium

Systemtic Name: 2-[2-[2-(benzotriazol-1-yl)ethanoylamino]benzimidazol-1-yl]ethyl-diethyl-azanium Openeye Name: 2-[2-[[2-(benzotriazol-1-yl)acetyl]amino]benzimidazol-1-yl]ethyl-diethyl-ammonium CAS Name: 2-[2-[[2-(1-benzotriazolyl)-1-oxoethyl]amino]-1-benzimidazolyl]ethyl-diethylammonium IUPAC Name: 2-[2-[[2-(benzotriazol-1-yl)acetyl]amino]benzimidazol-1-yl]ethyl-diethylazanium Traditional Name: 2-[2-[[2-(benzotriazol-1-yl)acetyl]amino]benzimidazol-1-yl]ethyl-diethyl-ammonium Formula: C21H26N7O+ MolecularWeight: 392.47744

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN1C2=CC=CC=C2N=C1NC(=O)CN3C4=CC=CC=C4N=N3

Isomeric SMILES

CC[NH+](CC)CCN1C2=CC=CC=C2N=C1NC(=O)CN3C4=CC=CC=C4N=N3

InChI

InChI=1S/C21H25N7O/c1-3-26(4-2)13-14-27-18-11-7-5-9-16(18)22-21(27)23-20(29)15-28-19-12-8-6-10-17(19)24-25-28/h5-12H,3-4,13-15H2,1-2H3,(H,22,23,29)/p+1