3-(2H-benzotriazol-5-ylcarbonylamino)propyl-methyl-(phenylmethyl)azanium

Systemtic Name: 3-(2H-benzotriazol-5-ylcarbonylamino)propyl-methyl-(phenylmethyl)azanium Openeye Name: 3-(2H-benzotriazole-5-carbonylamino)propyl-benzyl-methyl-ammonium CAS Name: 3-[[2H-benzotriazol-5-yl(oxo)methyl]amino]propyl-methyl-(phenylmethyl)ammonium IUPAC Name: 3-(2H-benzotriazole-5-carbonylamino)propyl-benzyl-methylazanium Traditional Name: 3-(2H-benzotriazole-5-carbonylamino)propyl-benzyl-methyl-ammonium Formula: C18H22N5O+ MolecularWeight: 324.40018

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCCNC(=O)C1=CC2=NNN=C2C=C1)CC3=CC=CC=C3

Isomeric SMILES

C[NH+](CCCNC(=O)C1=CC2=NNN=C2C=C1)CC3=CC=CC=C3

InChI

InChI=1S/C18H21N5O/c1-23(13-14-6-3-2-4-7-14)11-5-10-19-18(24)15-8-9-16-17(12-15)21-22-20-16/h2-4,6-9,12H,5,10-11,13H2,1H3,(H,19,24)(H,20,21,22)/p+1