[(3S)-1-[5-(tert-butylcarbamoyl)-1-(3-methylbutyl)-4-oxidanylidene-pyridin-3-yl]carbonylpyrrolidin-3-yl]-diethyl-azanium

Systemtic Name: [(3S)-1-[5-(tert-butylcarbamoyl)-1-(3-methylbutyl)-4-oxidanylidene-pyridin-3-yl]carbonylpyrrolidin-3-yl]-diethyl-azanium Openeye Name: [(3S)-1-[5-(tert-butylcarbamoyl)-1-isopentyl-4-oxo-pyridine-3-carbonyl]pyrrolidin-3-yl]-diethyl-ammonium CAS Name: [(3S)-1-[[5-[(tert-butylamino)-oxomethyl]-1-(3-methylbutyl)-4-oxo-3-pyridinyl]-oxomethyl]-3-pyrrolidinyl]-diethylammonium IUPAC Name: [(3S)-1-[5-(tert-butylcarbamoyl)-1-(3-methylbutyl)-4-oxopyridine-3-carbonyl]pyrrolidin-3-yl]-diethylazanium Traditional Name: [(3S)-1-[5-(tert-butylcarbamoyl)-1-isoamyl-4-keto-nicotinoyl]pyrrolidin-3-yl]-diethyl-ammonium Formula: C24H41N4O3+ MolecularWeight: 433.60734

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C1CCN(C1)C(=O)C2=CN(C=C(C2=O)C(=O)NC(C)(C)C)CCC(C)C

Isomeric SMILES

CC[NH+](CC)[C@H]1CCN(C1)C(=O)C2=CN(C=C(C2=O)C(=O)NC(C)(C)C)CCC(C)C

InChI

InChI=1S/C24H40N4O3/c1-8-27(9-2)18-11-13-28(14-18)23(31)20-16-26(12-10-17(3)4)15-19(21(20)29)22(30)25-24(5,6)7/h15-18H,8-14H2,1-7H3,(H,25,30)/p+1/t18-/m0/s1