[3-[[2-cyclohexyl-2-(3-phenylpropanoylamino)propanoyl]amino]-4-oxidanylidene-azetidin-2-yl] ethanoate

Systemtic Name: [3-[[2-cyclohexyl-2-(3-phenylpropanoylamino)propanoyl]amino]-4-oxidanylidene-azetidin-2-yl] ethanoate Openeye Name: [3-[[2-cyclohexyl-2-(3-phenylpropanoylamino)propanoyl]amino]-4-oxo-azetidin-2-yl] acetate CAS Name: acetic acid [3-[[2-cyclohexyl-1-oxo-2-[(1-oxo-3-phenylpropyl)amino]propyl]amino]-4-oxo-2-azetidinyl] ester IUPAC Name: [3-[[2-cyclohexyl-2-(3-phenylpropanoylamino)propanoyl]amino]-4-oxoazetidin-2-yl] acetate Traditional Name: acetic acid [3-[[2-cyclohexyl-2-(hydrocinnamoylamino)propanoyl]amino]-4-keto-azetidin-2-yl] ester Formula: C23H31N3O5 MolecularWeight: 429.50934

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(C(=O)N1)NC(=O)C(C)(C2CCCCC2)NC(=O)CCC3=CC=CC=C3

Isomeric SMILES

CC(=O)OC1C(C(=O)N1)NC(=O)C(C)(C2CCCCC2)NC(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C23H31N3O5/c1-15(27)31-21-19(20(29)25-21)24-22(30)23(2,17-11-7-4-8-12-17)26-18(28)14-13-16-9-5-3-6-10-16/h3,5-6,9-10,17,19,21H,4,7-8,11-14H2,1-2H3,(H,24,30)(H,25,29)(H,26,28)