diethyl-[(3S)-1-[1-(3-methylbutyl)-5-(2-methylpropylcarbamoyl)-4-oxidanylidene-pyridin-3-yl]carbonylpyrrolidin-3-yl]azanium

Systemtic Name: diethyl-[(3S)-1-[1-(3-methylbutyl)-5-(2-methylpropylcarbamoyl)-4-oxidanylidene-pyridin-3-yl]carbonylpyrrolidin-3-yl]azanium Openeye Name: diethyl-[(3S)-1-[5-(isobutylcarbamoyl)-1-isopentyl-4-oxo-pyridine-3-carbonyl]pyrrolidin-3-yl]ammonium CAS Name: diethyl-[(3S)-1-[[1-(3-methylbutyl)-5-[(2-methylpropylamino)-oxomethyl]-4-oxo-3-pyridinyl]-oxomethyl]-3-pyrrolidinyl]ammonium IUPAC Name: diethyl-[(3S)-1-[1-(3-methylbutyl)-5-(2-methylpropylcarbamoyl)-4-oxopyridine-3-carbonyl]pyrrolidin-3-yl]azanium Traditional Name: diethyl-[(3S)-1-[1-isoamyl-5-(isobutylcarbamoyl)-4-keto-nicotinoyl]pyrrolidin-3-yl]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)NCC(C)C)CCC(C)C

Isomeric SMILES

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

InChI

InChI=1S/C24H40N4O3/c1-7-27(8-2)19-10-12-28(14-19)24(31)21-16-26(11-9-17(3)4)15-20(22(21)29)23(30)25-13-18(5)6/h15-19H,7-14H2,1-6H3,(H,25,30)/p+1/t19-/m0/s1