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

Systemtic Name: [3-[[3-cyclohexyl-2-[(phenylmethyl)carbamoylamino]propanoyl]amino]-4-oxidanylidene-azetidin-2-yl] ethanoate Openeye Name: [3-[[2-(benzylcarbamoylamino)-3-cyclohexyl-propanoyl]amino]-4-oxo-azetidin-2-yl] acetate CAS Name: acetic acid [3-[[3-cyclohexyl-1-oxo-2-[[oxo-[(phenylmethyl)amino]methyl]amino]propyl]amino]-4-oxo-2-azetidinyl] ester IUPAC Name: [3-[[2-(benzylcarbamoylamino)-3-cyclohexylpropanoyl]amino]-4-oxoazetidin-2-yl] acetate Traditional Name: acetic acid [3-[[2-(benzylcarbamoylamino)-3-cyclohexyl-propanoyl]amino]-4-keto-azetidin-2-yl] ester Formula: C22H30N4O5 MolecularWeight: 430.4974

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(C(=O)N1)NC(=O)C(CC2CCCCC2)NC(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC(=O)OC1C(C(=O)N1)NC(=O)C(CC2CCCCC2)NC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C22H30N4O5/c1-14(27)31-21-18(20(29)26-21)25-19(28)17(12-15-8-4-2-5-9-15)24-22(30)23-13-16-10-6-3-7-11-16/h3,6-7,10-11,15,17-18,21H,2,4-5,8-9,12-13H2,1H3,(H,25,28)(H,26,29)(H2,23,24,30)