[(3S)-1-[5-(butylcarbamoyl)-1-cyclohexyl-4-oxidanylidene-pyridin-3-yl]carbonylpyrrolidin-3-yl]-dimethyl-azanium

Systemtic Name: [(3S)-1-[5-(butylcarbamoyl)-1-cyclohexyl-4-oxidanylidene-pyridin-3-yl]carbonylpyrrolidin-3-yl]-dimethyl-azanium Openeye Name: [(3S)-1-[5-(butylcarbamoyl)-1-cyclohexyl-4-oxo-pyridine-3-carbonyl]pyrrolidin-3-yl]-dimethyl-ammonium CAS Name: [(3S)-1-[[5-[butylamino(oxo)methyl]-1-cyclohexyl-4-oxo-3-pyridinyl]-oxomethyl]-3-pyrrolidinyl]-dimethylammonium IUPAC Name: [(3S)-1-[5-(butylcarbamoyl)-1-cyclohexyl-4-oxopyridine-3-carbonyl]pyrrolidin-3-yl]-dimethylazanium Traditional Name: [(3S)-1-[5-(butylcarbamoyl)-1-cyclohexyl-4-keto-nicotinoyl]pyrrolidin-3-yl]-dimethyl-ammonium Formula: C23H37N4O3+ MolecularWeight: 417.56488

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CN(C=C(C1=O)C(=O)N2CCC(C2)[NH+](C)C)C3CCCCC3

Isomeric SMILES

CCCCNC(=O)C1=CN(C=C(C1=O)C(=O)N2CC[C@@H](C2)[NH+](C)C)C3CCCCC3

InChI

InChI=1S/C23H36N4O3/c1-4-5-12-24-22(29)19-15-27(17-9-7-6-8-10-17)16-20(21(19)28)23(30)26-13-11-18(14-26)25(2)3/h15-18H,4-14H2,1-3H3,(H,24,29)/p+1/t18-/m0/s1