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

Systemtic Name: [(3S)-1-[1-cyclopentyl-5-(3-methylbutylcarbamoyl)-4-oxidanylidene-pyridin-3-yl]carbonylpyrrolidin-3-yl]-diethyl-azanium Openeye Name: [(3S)-1-[1-cyclopentyl-5-(isopentylcarbamoyl)-4-oxo-pyridine-3-carbonyl]pyrrolidin-3-yl]-diethyl-ammonium CAS Name: [(3S)-1-[[1-cyclopentyl-5-[(3-methylbutylamino)-oxomethyl]-4-oxo-3-pyridinyl]-oxomethyl]-3-pyrrolidinyl]-diethylammonium IUPAC Name: [(3S)-1-[1-cyclopentyl-5-(3-methylbutylcarbamoyl)-4-oxopyridine-3-carbonyl]pyrrolidin-3-yl]-diethylazanium Traditional Name: [(3S)-1-[1-cyclopentyl-5-(isoamylcarbamoyl)-4-keto-nicotinoyl]pyrrolidin-3-yl]-diethyl-ammonium Formula: C25H41N4O3+ MolecularWeight: 445.61804

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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)NCCC(C)C)C3CCCC3

Isomeric SMILES

CC[NH+](CC)[C@H]1CCN(C1)C(=O)C2=CN(C=C(C2=O)C(=O)NCCC(C)C)C3CCCC3

InChI

InChI=1S/C25H40N4O3/c1-5-27(6-2)20-12-14-28(15-20)25(32)22-17-29(19-9-7-8-10-19)16-21(23(22)30)24(31)26-13-11-18(3)4/h16-20H,5-15H2,1-4H3,(H,26,31)/p+1/t20-/m0/s1