[(3R,4S,5S)-2-acetyloxy-4-[(4-nitrophenyl)carbonylamino]-5-piperidin-1-ylcarbonyl-oxolan-3-yl] ethanoate

Systemtic Name: [(3R,4S,5S)-2-acetyloxy-4-[(4-nitrophenyl)carbonylamino]-5-piperidin-1-ylcarbonyl-oxolan-3-yl] ethanoate Openeye Name: [(3R,4S,5S)-2-acetoxy-4-[(4-nitrobenzoyl)amino]-5-(piperidine-1-carbonyl)tetrahydrofuran-3-yl] acetate CAS Name: acetic acid [(3R,4S,5S)-2-acetyloxy-4-[[(4-nitrophenyl)-oxomethyl]amino]-5-[oxo(1-piperidinyl)methyl]-3-oxolanyl] ester IUPAC Name: [(3R,4S,5S)-2-acetyloxy-4-[(4-nitrobenzoyl)amino]-5-(piperidine-1-carbonyl)oxolan-3-yl] acetate Traditional Name: acetic acid [(3R,4S,5S)-2-acetoxy-4-[(4-nitrobenzoyl)amino]-5-(piperidine-1-carbonyl)tetrahydrofuran-3-yl] ester Formula: C21H25N3O9 MolecularWeight: 463.4379

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(C(OC1OC(=O)C)C(=O)N2CCCCC2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)O[C@@H]1[C@@H]([C@H](OC1OC(=O)C)C(=O)N2CCCCC2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H25N3O9/c1-12(25)31-18-16(22-19(27)14-6-8-15(9-7-14)24(29)30)17(33-21(18)32-13(2)26)20(28)23-10-4-3-5-11-23/h6-9,16-18,21H,3-5,10-11H2,1-2H3,(H,22,27)/t16-,17+,18-,21?/m1/s1