(4-tert-butylphenyl)methyl-[2-[(5-chloranyl-2-methoxy-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: (4-tert-butylphenyl)methyl-[2-[(5-chloranyl-2-methoxy-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: (4-tert-butylphenyl)methyl-[2-(5-chloro-2-methoxy-anilino)-2-oxo-ethyl]-methyl-ammonium CAS Name: (4-tert-butylphenyl)methyl-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-methylammonium IUPAC Name: (4-tert-butylphenyl)methyl-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-methylazanium Traditional Name: (4-tert-butylbenzyl)-[2-(5-chloro-2-methoxy-anilino)-2-keto-ethyl]-methyl-ammonium Formula: C21H28ClN2O2+ MolecularWeight: 375.91222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27ClN2O2/c1-21(2,3)16-8-6-15(7-9-16)13-24(4)14-20(25)23-18-12-17(22)10-11-19(18)26-5/h6-12H,13-14H2,1-5H3,(H,23,25)/p+1