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

Systemtic Name: [3-[[3-cyclohexyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]-4-oxidanylidene-azetidin-2-yl] ethanoate Openeye Name: [3-[[2-(benzyloxycarbonylamino)-3-cyclohexyl-propanoyl]amino]-4-oxo-azetidin-2-yl] acetate CAS Name: acetic acid [3-[[3-cyclohexyl-1-oxo-2-(phenylmethoxycarbonylamino)propyl]amino]-4-oxo-2-azetidinyl] ester IUPAC Name: [3-[[3-cyclohexyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]-4-oxoazetidin-2-yl] acetate Traditional Name: acetic acid [3-[[2-(benzyloxycarbonylamino)-3-cyclohexyl-propanoyl]amino]-4-keto-azetidin-2-yl] ester Formula: C22H29N3O6 MolecularWeight: 431.48216

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(C(=O)N1)NC(=O)C(CC2CCCCC2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(=O)OC1C(C(=O)N1)NC(=O)C(CC2CCCCC2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H29N3O6/c1-14(26)31-21-18(20(28)25-21)24-19(27)17(12-15-8-4-2-5-9-15)23-22(29)30-13-16-10-6-3-7-11-16/h3,6-7,10-11,15,17-18,21H,2,4-5,8-9,12-13H2,1H3,(H,23,29)(H,24,27)(H,25,28)