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1-azanylethyl(trimethyl)azanium; 2-[3-(benzotriazol-2-yl)-4-oxidanyl-phenyl]propanoyl chloride

1-azanylethyl(trimethyl)azanium; 2-[3-(benzotriazol-2-yl)-4-oxidanyl-phenyl]propanoyl chloride

Systemtic Name:1-azanylethyl(trimethyl)azanium; 2-[3-(benzotriazol-2-yl)-4-oxidanyl-phenyl]propanoyl chloride
Openeye Name:1-aminoethyl(trimethyl)ammonium; 2-[3-(benzotriazol-2-yl)-4-hydroxy-phenyl]propanoyl chloride
CAS Name:1-aminoethyl(trimethyl)ammonium; 2-[3-(2-benzotriazolyl)-4-hydroxyphenyl]propanoyl chloride
IUPAC Name:1-aminoethyl(trimethyl)azanium; 2-[3-(benzotriazol-2-yl)-4-hydroxyphenyl]propanoyl chloride
Traditional Name:1-aminoethyl(trimethyl)ammonium; 2-[3-(benzotriazol-2-yl)-4-hydroxy-phenyl]propionyl chloride
Formula: C20H27ClN5O2+
MolecularWeight: 404.91368
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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)O)N2N=C3C=CC=CC3=N2)C(=O)Cl.CC(N)[N+](C)(C)C


Isomeric SMILES

CC(C1=CC(=C(C=C1)O)N2N=C3C=CC=CC3=N2)C(=O)Cl.CC(N)[N+](C)(C)C


InChI

InChI=1S/C15H12ClN3O2.C5H15N2/c1-9(15(16)21)10-6-7-14(20)13(8-10)19-17-11-4-2-3-5-12(11)18-19;1-5(6)7(2,3)4/h2-9,20H,1H3;5H,6H2,1-4H3/q;+1


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