(4-tert-butylphenyl)methyl-[2-[(3-chloranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: (4-tert-butylphenyl)methyl-[2-[(3-chloranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: (4-tert-butylphenyl)methyl-[2-(3-chloro-4-methyl-anilino)-2-oxo-ethyl]-methyl-ammonium CAS Name: (4-tert-butylphenyl)methyl-[2-(3-chloro-4-methylanilino)-2-oxoethyl]-methylammonium IUPAC Name: (4-tert-butylphenyl)methyl-[2-(3-chloro-4-methylanilino)-2-oxoethyl]-methylazanium Traditional Name: (4-tert-butylbenzyl)-[2-(3-chloro-4-methyl-anilino)-2-keto-ethyl]-methyl-ammonium Formula: C21H28ClN2O+ MolecularWeight: 359.91282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C[NH+](C)CC2=CC=C(C=C2)C(C)(C)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C[NH+](C)CC2=CC=C(C=C2)C(C)(C)C)Cl

InChI

InChI=1S/C21H27ClN2O/c1-15-6-11-18(12-19(15)22)23-20(25)14-24(5)13-16-7-9-17(10-8-16)21(2,3)4/h6-12H,13-14H2,1-5H3,(H,23,25)/p+1