(1S,2S,3S,4R)-3-(1-acetamido-2-ethyl-butyl)-4-[[(acetyloxymethoxycarbonylamino)-azanyl-methylidene]amino]-2-oxidanyl-cyclopentane-1-carboxylic acid

Systemtic Name: (1S,2S,3S,4R)-3-(1-acetamido-2-ethyl-butyl)-4-[[(acetyloxymethoxycarbonylamino)-azanyl-methylidene]amino]-2-oxidanyl-cyclopentane-1-carboxylic acid Openeye Name: (1S,2S,3S,4R)-3-(1-acetamido-2-ethyl-butyl)-4-[[(acetoxymethoxycarbonylamino)-amino-methylene]amino]-2-hydroxy-cyclopentanecarboxylic acid CAS Name: (1S,2S,3S,4R)-3-(1-acetamido-2-ethylbutyl)-4-[[[[acetyloxymethoxy(oxo)methyl]amino]-aminomethylidene]amino]-2-hydroxy-1-cyclopentanecarboxylic acid IUPAC Name: (1S,2S,3S,4R)-3-(1-acetamido-2-ethylbutyl)-4-[[(acetyloxymethoxycarbonylamino)-aminomethylidene]amino]-2-hydroxycyclopentane-1-carboxylic acid Traditional Name: (1S,2S,3S,4R)-3-(1-acetamido-2-ethyl-butyl)-4-[[(acetoxymethoxycarbonylamino)-amino-methylene]amino]-2-hydroxy-cyclopentanecarboxylic acid Formula: C19H32N4O8 MolecularWeight: 444.47938

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(C1C(CC(C1O)C(=O)O)N=C(N)NC(=O)OCOC(=O)C)NC(=O)C

Isomeric SMILES

CCC(CC)C([C@H]1[C@@H](C[C@@H]([C@H]1O)C(=O)O)N=C(N)NC(=O)OCOC(=O)C)NC(=O)C

InChI

InChI=1S/C19H32N4O8/c1-5-11(6-2)15(21-9(3)24)14-13(7-12(16(14)26)17(27)28)22-18(20)23-19(29)31-8-30-10(4)25/h11-16,26H,5-8H2,1-4H3,(H,21,24)(H,27,28)(H3,20,22,23,29)/t12-,13+,14+,15?,16+/m0/s1