3-[4-(6-chloranyl-1-oxidanidyl-benzotriazol-1-ium-2-yl)phenoxy]-N,N-dimethyl-propan-1-amine

Systemtic Name: 3-[4-(6-chloranyl-1-oxidanidyl-benzotriazol-1-ium-2-yl)phenoxy]-N,N-dimethyl-propan-1-amine Openeye Name: 3-[4-(6-chloro-1-oxido-benzotriazol-1-ium-2-yl)phenoxy]-N,N-dimethyl-propan-1-amine CAS Name: 3-[4-(6-chloro-1-oxido-2-benzotriazol-1-iumyl)phenoxy]-N,N-dimethyl-1-propanamine IUPAC Name: 3-[4-(6-chloro-1-oxidobenzotriazol-1-ium-2-yl)phenoxy]-N,N-dimethylpropan-1-amine Traditional Name: 3-[4-(6-chloro-1-oxido-benzotriazol-1-ium-2-yl)phenoxy]propyl-dimethyl-amine Formula: C17H19ClN4O2 MolecularWeight: 346.81136

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCOC1=CC=C(C=C1)N2N=C3C=CC(=CC3=[N+]2[O-])Cl

Isomeric SMILES

CN(C)CCCOC1=CC=C(C=C1)N2N=C3C=CC(=CC3=[N+]2[O-])Cl

InChI

InChI=1S/C17H19ClN4O2/c1-20(2)10-3-11-24-15-7-5-14(6-8-15)21-19-16-9-4-13(18)12-17(16)22(21)23/h4-9,12H,3,10-11H2,1-2H3