[2-[[2-(benzotriazol-1-yl)ethanoylamino]methyl]phenyl]methyl-diethyl-azanium

Systemtic Name: [2-[[2-(benzotriazol-1-yl)ethanoylamino]methyl]phenyl]methyl-diethyl-azanium Openeye Name: [2-[[[2-(benzotriazol-1-yl)acetyl]amino]methyl]phenyl]methyl-diethyl-ammonium CAS Name: [2-[[[2-(1-benzotriazolyl)-1-oxoethyl]amino]methyl]phenyl]methyl-diethylammonium IUPAC Name: [2-[[[2-(benzotriazol-1-yl)acetyl]amino]methyl]phenyl]methyl-diethylazanium Traditional Name: [2-[[[2-(benzotriazol-1-yl)acetyl]amino]methyl]benzyl]-diethyl-ammonium Formula: C20H26N5O+ MolecularWeight: 352.45334

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=CC=CC=C1CNC(=O)CN2C3=CC=CC=C3N=N2

Isomeric SMILES

CC[NH+](CC)CC1=CC=CC=C1CNC(=O)CN2C3=CC=CC=C3N=N2

InChI

InChI=1S/C20H25N5O/c1-3-24(4-2)14-17-10-6-5-9-16(17)13-21-20(26)15-25-19-12-8-7-11-18(19)22-23-25/h5-12H,3-4,13-15H2,1-2H3,(H,21,26)/p+1