2-[3-[(4-fluorophenyl)methylcarbamoyl]-6-methyl-4-oxidanylidene-2-phenethyl-pyridin-1-yl]ethyl-dimethyl-azanium

Systemtic Name: 2-[3-[(4-fluorophenyl)methylcarbamoyl]-6-methyl-4-oxidanylidene-2-phenethyl-pyridin-1-yl]ethyl-dimethyl-azanium Openeye Name: 2-[3-[(4-fluorophenyl)methylcarbamoyl]-6-methyl-4-oxo-2-phenethyl-1-pyridyl]ethyl-dimethyl-ammonium CAS Name: 2-[3-[[(4-fluorophenyl)methylamino]-oxomethyl]-6-methyl-4-oxo-2-phenethyl-1-pyridinyl]ethyl-dimethylammonium IUPAC Name: 2-[3-[(4-fluorophenyl)methylcarbamoyl]-6-methyl-4-oxo-2-phenethylpyridin-1-yl]ethyl-dimethylazanium Traditional Name: 2-[3-[(4-fluorobenzyl)carbamoyl]-4-keto-6-methyl-2-phenethyl-1-pyridyl]ethyl-dimethyl-ammonium Formula: C26H31FN3O2+ MolecularWeight: 436.541643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C(N1CC[NH+](C)C)CCC2=CC=CC=C2)C(=O)NCC3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC(=O)C(=C(N1CC[NH+](C)C)CCC2=CC=CC=C2)C(=O)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C26H30FN3O2/c1-19-17-24(31)25(26(32)28-18-21-9-12-22(27)13-10-21)23(30(19)16-15-29(2)3)14-11-20-7-5-4-6-8-20/h4-10,12-13,17H,11,14-16,18H2,1-3H3,(H,28,32)/p+1