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

Systemtic Name: 2-[3-(cyclohexylmethylcarbamoyl)-6-methyl-4-oxidanylidene-2-phenethyl-pyridin-1-yl]ethyl-dimethyl-azanium Openeye Name: 2-[3-(cyclohexylmethylcarbamoyl)-6-methyl-4-oxo-2-phenethyl-1-pyridyl]ethyl-dimethyl-ammonium CAS Name: 2-[3-[(cyclohexylmethylamino)-oxomethyl]-6-methyl-4-oxo-2-phenethyl-1-pyridinyl]ethyl-dimethylammonium IUPAC Name: 2-[3-(cyclohexylmethylcarbamoyl)-6-methyl-4-oxo-2-phenethylpyridin-1-yl]ethyl-dimethylazanium Traditional Name: 2-[3-(cyclohexylmethylcarbamoyl)-4-keto-6-methyl-2-phenethyl-1-pyridyl]ethyl-dimethyl-ammonium Formula: C26H38N3O2+ MolecularWeight: 424.59882

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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)NCC3CCCCC3

Isomeric SMILES

CC1=CC(=O)C(=C(N1CC[NH+](C)C)CCC2=CC=CC=C2)C(=O)NCC3CCCCC3

InChI

InChI=1S/C26H37N3O2/c1-20-18-24(30)25(26(31)27-19-22-12-8-5-9-13-22)23(29(20)17-16-28(2)3)15-14-21-10-6-4-7-11-21/h4,6-7,10-11,18,22H,5,8-9,12-17,19H2,1-3H3,(H,27,31)/p+1