dimethyl-[2-[6-methyl-3-[(3-methyl-1,2-oxazol-5-yl)methylcarbamoyl]-4-oxidanylidene-2-phenethyl-pyridin-1-yl]ethyl]azanium

Systemtic Name: dimethyl-[2-[6-methyl-3-[(3-methyl-1,2-oxazol-5-yl)methylcarbamoyl]-4-oxidanylidene-2-phenethyl-pyridin-1-yl]ethyl]azanium Openeye Name: dimethyl-[2-[6-methyl-3-[(3-methylisoxazol-5-yl)methylcarbamoyl]-4-oxo-2-phenethyl-1-pyridyl]ethyl]ammonium CAS Name: dimethyl-[2-[6-methyl-3-[[(3-methyl-5-isoxazolyl)methylamino]-oxomethyl]-4-oxo-2-phenethyl-1-pyridinyl]ethyl]ammonium IUPAC Name: dimethyl-[2-[6-methyl-3-[(3-methyl-1,2-oxazol-5-yl)methylcarbamoyl]-4-oxo-2-phenethylpyridin-1-yl]ethyl]azanium Traditional Name: 2-[4-keto-6-methyl-3-[(3-methylisoxazol-5-yl)methylcarbamoyl]-2-phenethyl-1-pyridyl]ethyl-dimethyl-ammonium Formula: C24H31N4O3+ MolecularWeight: 423.52794

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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(=NO3)C

Isomeric SMILES

CC1=CC(=O)C(=C(N1CC[NH+](C)C)CCC2=CC=CC=C2)C(=O)NCC3=CC(=NO3)C

InChI

InChI=1S/C24H30N4O3/c1-17-14-20(31-26-17)16-25-24(30)23-21(11-10-19-8-6-5-7-9-19)28(13-12-27(3)4)18(2)15-22(23)29/h5-9,14-15H,10-13,16H2,1-4H3,(H,25,30)/p+1