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

Systemtic Name: [2-[(4-tert-butylphenyl)amino]-2-oxidanylidene-ethyl]-[(3-fluorophenyl)methyl]-methyl-azanium Openeye Name: [2-(4-tert-butylanilino)-2-oxo-ethyl]-[(3-fluorophenyl)methyl]-methyl-ammonium CAS Name: [2-(4-tert-butylanilino)-2-oxoethyl]-[(3-fluorophenyl)methyl]-methylammonium IUPAC Name: [2-(4-tert-butylanilino)-2-oxoethyl]-[(3-fluorophenyl)methyl]-methylazanium Traditional Name: [2-(4-tert-butylanilino)-2-keto-ethyl]-(3-fluorobenzyl)-methyl-ammonium Formula: C20H26FN2O+ MolecularWeight: 329.431643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25FN2O/c1-20(2,3)16-8-10-18(11-9-16)22-19(24)14-23(4)13-15-6-5-7-17(21)12-15/h5-12H,13-14H2,1-4H3,(H,22,24)/p+1