[3-[[3-cyclohexyl-2-(1-phenylethenylsulfonylamino)propanoyl]amino]-4-oxidanylidene-azetidin-2-yl] ethanoate

Systemtic Name: [3-[[3-cyclohexyl-2-(1-phenylethenylsulfonylamino)propanoyl]amino]-4-oxidanylidene-azetidin-2-yl] ethanoate Openeye Name: [3-[[3-cyclohexyl-2-(1-phenylvinylsulfonylamino)propanoyl]amino]-4-oxo-azetidin-2-yl] acetate CAS Name: acetic acid [3-[[3-cyclohexyl-1-oxo-2-(1-phenylethenylsulfonylamino)propyl]amino]-4-oxo-2-azetidinyl] ester IUPAC Name: [3-[[3-cyclohexyl-2-(1-phenylethenylsulfonylamino)propanoyl]amino]-4-oxoazetidin-2-yl] acetate Traditional Name: acetic acid [3-[[3-cyclohexyl-2-(1-phenylvinylsulfonylamino)propanoyl]amino]-4-keto-azetidin-2-yl] ester Formula: C22H29N3O6S MolecularWeight: 463.54716

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29N3O6S/c1-14(17-11-7-4-8-12-17)32(29,30)25-18(13-16-9-5-3-6-10-16)20(27)23-19-21(28)24-22(19)31-15(2)26/h4,7-8,11-12,16,18-19,22,25H,1,3,5-6,9-10,13H2,2H3,(H,23,27)(H,24,28)