tert-butyl (2S,3S)-1-(4-methoxyphenyl)-4-oxidanylidene-3-propyl-azetidine-2-carboxylate

Systemtic Name: tert-butyl (2S,3S)-1-(4-methoxyphenyl)-4-oxidanylidene-3-propyl-azetidine-2-carboxylate Openeye Name: tert-butyl (2S,3S)-1-(4-methoxyphenyl)-4-oxo-3-propyl-azetidine-2-carboxylate CAS Name: (2S,3S)-1-(4-methoxyphenyl)-4-oxo-3-propyl-2-azetidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S,3S)-1-(4-methoxyphenyl)-4-oxo-3-propylazetidine-2-carboxylate Traditional Name: (2S,3S)-4-keto-1-(4-methoxyphenyl)-3-propyl-azetidine-2-carboxylic acid tert-butyl ester Formula: C18H25NO4 MolecularWeight: 319.3954

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(N(C1=O)C2=CC=C(C=C2)OC)C(=O)OC(C)(C)C

Isomeric SMILES

CCC[C@H]1[C@H](N(C1=O)C2=CC=C(C=C2)OC)C(=O)OC(C)(C)C

InChI

InChI=1S/C18H25NO4/c1-6-7-14-15(17(21)23-18(2,3)4)19(16(14)20)12-8-10-13(22-5)11-9-12/h8-11,14-15H,6-7H2,1-5H3/t14-,15-/m0/s1