methyl (2S)-2-[[5-acetamido-1-[(2S)-1-methoxy-3-methyl-1-oxidanylidene-butan-2-yl]-2-methyl-6-oxidanylidene-pyridin-3-yl]carbonylamino]-3-methyl-butanoate

Systemtic Name: methyl (2S)-2-[[5-acetamido-1-[(2S)-1-methoxy-3-methyl-1-oxidanylidene-butan-2-yl]-2-methyl-6-oxidanylidene-pyridin-3-yl]carbonylamino]-3-methyl-butanoate Openeye Name: methyl (2S)-2-[[5-acetamido-1-[(1S)-1-methoxycarbonyl-2-methyl-propyl]-2-methyl-6-oxo-pyridine-3-carbonyl]amino]-3-methyl-butanoate CAS Name: (2S)-2-[[[5-acetamido-1-[(2S)-1-methoxy-3-methyl-1-oxobutan-2-yl]-2-methyl-6-oxo-3-pyridinyl]-oxomethyl]amino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[5-acetamido-1-[(2S)-1-methoxy-3-methyl-1-oxobutan-2-yl]-2-methyl-6-oxopyridine-3-carbonyl]amino]-3-methylbutanoate Traditional Name: (2S)-2-[[5-acetamido-1-[(1S)-1-carbomethoxy-2-methyl-propyl]-6-keto-2-methyl-nicotinoyl]amino]-3-methyl-butyric acid methyl ester Formula: C21H31N3O7 MolecularWeight: 437.48674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=O)N1C(C(C)C)C(=O)OC)NC(=O)C)C(=O)NC(C(C)C)C(=O)OC

Isomeric SMILES

CC1=C(C=C(C(=O)N1[C@@H](C(C)C)C(=O)OC)NC(=O)C)C(=O)N[C@@H](C(C)C)C(=O)OC

InChI

InChI=1S/C21H31N3O7/c1-10(2)16(20(28)30-7)23-18(26)14-9-15(22-13(6)25)19(27)24(12(14)5)17(11(3)4)21(29)31-8/h9-11,16-17H,1-8H3,(H,22,25)(H,23,26)/t16-,17-/m0/s1