[2-acetyloxy-3-[[3-azanyl-5-(2,3-diacetyloxypropylcarbamoyl)phenyl]carbonylamino]propyl] ethanoate

Systemtic Name: [2-acetyloxy-3-[[3-azanyl-5-(2,3-diacetyloxypropylcarbamoyl)phenyl]carbonylamino]propyl] ethanoate Openeye Name: [2-acetoxy-3-[[3-amino-5-(2,3-diacetoxypropylcarbamoyl)benzoyl]amino]propyl] acetate CAS Name: acetic acid [2-acetyloxy-3-[[[3-amino-5-[(2,3-diacetyloxypropylamino)-oxomethyl]phenyl]-oxomethyl]amino]propyl] ester IUPAC Name: [2-acetyloxy-3-[[3-amino-5-(2,3-diacetyloxypropylcarbamoyl)benzoyl]amino]propyl] acetate Traditional Name: acetic acid [2-acetoxy-3-[[3-amino-5-(2,3-diacetoxypropylcarbamoyl)benzoyl]amino]propyl] ester Formula: C22H29N3O10 MolecularWeight: 495.47976

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(CNC(=O)C1=CC(=CC(=C1)N)C(=O)NCC(COC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OCC(CNC(=O)C1=CC(=CC(=C1)N)C(=O)NCC(COC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C22H29N3O10/c1-12(26)32-10-19(34-14(3)28)8-24-21(30)16-5-17(7-18(23)6-16)22(31)25-9-20(35-15(4)29)11-33-13(2)27/h5-7,19-20H,8-11,23H2,1-4H3,(H,24,30)(H,25,31)