benzotriazol-1-ylmethyl-[2-[(4-chlorophenyl)methylamino]-2-oxidanylidene-ethyl]-ethyl-azanium

Systemtic Name: benzotriazol-1-ylmethyl-[2-[(4-chlorophenyl)methylamino]-2-oxidanylidene-ethyl]-ethyl-azanium Openeye Name: benzotriazol-1-ylmethyl-[2-[(4-chlorophenyl)methylamino]-2-oxo-ethyl]-ethyl-ammonium CAS Name: 1-benzotriazolylmethyl-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]-ethylammonium IUPAC Name: benzotriazol-1-ylmethyl-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]-ethylazanium Traditional Name: benzotriazol-1-ylmethyl-[2-[(4-chlorobenzyl)amino]-2-keto-ethyl]-ethyl-ammonium Formula: C18H21ClN5O+ MolecularWeight: 358.84524

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC(=O)NCC1=CC=C(C=C1)Cl)CN2C3=CC=CC=C3N=N2

Isomeric SMILES

CC[NH+](CC(=O)NCC1=CC=C(C=C1)Cl)CN2C3=CC=CC=C3N=N2

InChI

InChI=1S/C18H20ClN5O/c1-2-23(13-24-17-6-4-3-5-16(17)21-22-24)12-18(25)20-11-14-7-9-15(19)10-8-14/h3-10H,2,11-13H2,1H3,(H,20,25)/p+1