(4-nitrophenyl)methyl (4S)-4-[(2R,3R)-3-ethyl-4-oxidanylidene-azetidin-2-yl]-3-oxidanylidene-pentanoate

Systemtic Name: (4-nitrophenyl)methyl (4S)-4-[(2R,3R)-3-ethyl-4-oxidanylidene-azetidin-2-yl]-3-oxidanylidene-pentanoate Openeye Name: (4-nitrophenyl)methyl (4S)-4-[(2R,3R)-3-ethyl-4-oxo-azetidin-2-yl]-3-oxo-pentanoate CAS Name: (4S)-4-[(2R,3R)-3-ethyl-4-oxo-2-azetidinyl]-3-oxopentanoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl (4S)-4-[(2R,3R)-3-ethyl-4-oxoazetidin-2-yl]-3-oxopentanoate Traditional Name: (4S)-4-[(2R,3R)-3-ethyl-4-keto-azetidin-2-yl]-3-keto-valeric acid (4-nitrobenzyl) ester Formula: C17H20N2O6 MolecularWeight: 348.3505

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(NC1=O)C(C)C(=O)CC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC[C@@H]1[C@H](NC1=O)[C@H](C)C(=O)CC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H20N2O6/c1-3-13-16(18-17(13)22)10(2)14(20)8-15(21)25-9-11-4-6-12(7-5-11)19(23)24/h4-7,10,13,16H,3,8-9H2,1-2H3,(H,18,22)/t10-,13-,16-/m1/s1