[(3S)-1-[5-(cyclohexylmethylcarbamoyl)-1-cyclopropyl-4-oxidanylidene-pyridin-3-yl]carbonylpyrrolidin-3-yl]-diethyl-azanium

Systemtic Name: [(3S)-1-[5-(cyclohexylmethylcarbamoyl)-1-cyclopropyl-4-oxidanylidene-pyridin-3-yl]carbonylpyrrolidin-3-yl]-diethyl-azanium Openeye Name: [(3S)-1-[5-(cyclohexylmethylcarbamoyl)-1-cyclopropyl-4-oxo-pyridine-3-carbonyl]pyrrolidin-3-yl]-diethyl-ammonium CAS Name: [(3S)-1-[[5-[(cyclohexylmethylamino)-oxomethyl]-1-cyclopropyl-4-oxo-3-pyridinyl]-oxomethyl]-3-pyrrolidinyl]-diethylammonium IUPAC Name: [(3S)-1-[5-(cyclohexylmethylcarbamoyl)-1-cyclopropyl-4-oxopyridine-3-carbonyl]pyrrolidin-3-yl]-diethylazanium Traditional Name: [(3S)-1-[5-(cyclohexylmethylcarbamoyl)-1-cyclopropyl-4-keto-nicotinoyl]pyrrolidin-3-yl]-diethyl-ammonium Formula: C25H39N4O3+ MolecularWeight: 443.60216

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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)NCC3CCCCC3)C4CC4

Isomeric SMILES

CC[NH+](CC)[C@H]1CCN(C1)C(=O)C2=CN(C=C(C2=O)C(=O)NCC3CCCCC3)C4CC4

InChI

InChI=1S/C25H38N4O3/c1-3-27(4-2)20-12-13-28(15-20)25(32)22-17-29(19-10-11-19)16-21(23(22)30)24(31)26-14-18-8-6-5-7-9-18/h16-20H,3-15H2,1-2H3,(H,26,31)/p+1/t20-/m0/s1