(4-tert-butylphenyl)methyl-[2-[(2-chloranylpyridin-3-yl)amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: (4-tert-butylphenyl)methyl-[2-[(2-chloranylpyridin-3-yl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: (4-tert-butylphenyl)methyl-[2-[(2-chloro-3-pyridyl)amino]-2-oxo-ethyl]-methyl-ammonium CAS Name: (4-tert-butylphenyl)methyl-[2-[(2-chloro-3-pyridinyl)amino]-2-oxoethyl]-methylammonium IUPAC Name: (4-tert-butylphenyl)methyl-[2-[(2-chloropyridin-3-yl)amino]-2-oxoethyl]-methylazanium Traditional Name: (4-tert-butylbenzyl)-[2-[(2-chloro-3-pyridyl)amino]-2-keto-ethyl]-methyl-ammonium Formula: C19H25ClN3O+ MolecularWeight: 346.8743

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C[NH+](C)CC(=O)NC2=C(N=CC=C2)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C[NH+](C)CC(=O)NC2=C(N=CC=C2)Cl

InChI

InChI=1S/C19H24ClN3O/c1-19(2,3)15-9-7-14(8-10-15)12-23(4)13-17(24)22-16-6-5-11-21-18(16)20/h5-11H,12-13H2,1-4H3,(H,22,24)/p+1