ethyl 3-[(3S,4S)-3-[(1R,2R)-2-azido-1-oxidanyl-butyl]-3-bromanyl-2-oxidanylidene-4-phenyl-azetidin-1-yl]propanoate

Systemtic Name: ethyl 3-[(3S,4S)-3-[(1R,2R)-2-azido-1-oxidanyl-butyl]-3-bromanyl-2-oxidanylidene-4-phenyl-azetidin-1-yl]propanoate Openeye Name: ethyl 3-[(3S,4S)-3-[(1R,2R)-2-azido-1-hydroxy-butyl]-3-bromo-2-oxo-4-phenyl-azetidin-1-yl]propanoate CAS Name: 3-[(3S,4S)-3-[(1R,2R)-2-azido-1-hydroxybutyl]-3-bromo-2-oxo-4-phenyl-1-azetidinyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[(3S,4S)-3-[(1R,2R)-2-azido-1-hydroxybutyl]-3-bromo-2-oxo-4-phenylazetidin-1-yl]propanoate Traditional Name: 3-[(3S,4S)-3-[(1R,2R)-2-azido-1-hydroxy-butyl]-3-bromo-2-keto-4-phenyl-azetidin-1-yl]propionic acid ethyl ester Formula: C18H23BrN4O4 MolecularWeight: 439.30362

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C1(C(N(C1=O)CCC(=O)OCC)C2=CC=CC=C2)Br)O)N=[N+]=[N-]

Isomeric SMILES

CC[C@H]([C@H]([C@]1([C@@H](N(C1=O)CCC(=O)OCC)C2=CC=CC=C2)Br)O)N=[N+]=[N-]

InChI

InChI=1S/C18H23BrN4O4/c1-3-13(21-22-20)16(25)18(19)15(12-8-6-5-7-9-12)23(17(18)26)11-10-14(24)27-4-2/h5-9,13,15-16,25H,3-4,10-11H2,1-2H3/t13-,15+,16-,18+/m1/s1