benzotriazol-1-ylmethyl-[2-[(2,4-dichlorophenyl)amino]-2-oxidanylidene-ethyl]-propyl-azanium

Systemtic Name: benzotriazol-1-ylmethyl-[2-[(2,4-dichlorophenyl)amino]-2-oxidanylidene-ethyl]-propyl-azanium Openeye Name: benzotriazol-1-ylmethyl-[2-(2,4-dichloroanilino)-2-oxo-ethyl]-propyl-ammonium CAS Name: 1-benzotriazolylmethyl-[2-(2,4-dichloroanilino)-2-oxoethyl]-propylammonium IUPAC Name: benzotriazol-1-ylmethyl-[2-(2,4-dichloroanilino)-2-oxoethyl]-propylazanium Traditional Name: benzotriazol-1-ylmethyl-[2-(2,4-dichloroanilino)-2-keto-ethyl]-propyl-ammonium Formula: C18H20Cl2N5O+ MolecularWeight: 393.2903

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CC(=O)NC1=C(C=C(C=C1)Cl)Cl)CN2C3=CC=CC=C3N=N2

Isomeric SMILES

CCC[NH+](CC(=O)NC1=C(C=C(C=C1)Cl)Cl)CN2C3=CC=CC=C3N=N2

InChI

InChI=1S/C18H19Cl2N5O/c1-2-9-24(12-25-17-6-4-3-5-16(17)22-23-25)11-18(26)21-15-8-7-13(19)10-14(15)20/h3-8,10H,2,9,11-12H2,1H3,(H,21,26)/p+1