[3-(4-acetyloxy-5-azanyl-3-oxidanyl-6-oxidanylidene-6-phenyl-hexan-3-yl)phenyl] ethanoate

Systemtic Name: [3-(4-acetyloxy-5-azanyl-3-oxidanyl-6-oxidanylidene-6-phenyl-hexan-3-yl)phenyl] ethanoate Openeye Name: [3-(2-acetoxy-3-amino-1-ethyl-1-hydroxy-4-oxo-4-phenyl-butyl)phenyl] acetate CAS Name: acetic acid [3-(4-acetyloxy-5-amino-3-hydroxy-6-oxo-6-phenylhexan-3-yl)phenyl] ester IUPAC Name: [3-(4-acetyloxy-5-amino-3-hydroxy-6-oxo-6-phenylhexan-3-yl)phenyl] acetate Traditional Name: acetic acid [3-(2-acetoxy-3-amino-1-ethyl-1-hydroxy-4-keto-4-phenyl-butyl)phenyl] ester Formula: C22H25NO6 MolecularWeight: 399.437

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC(=CC=C1)OC(=O)C)(C(C(C(=O)C2=CC=CC=C2)N)OC(=O)C)O

Isomeric SMILES

CCC(C1=CC(=CC=C1)OC(=O)C)(C(C(C(=O)C2=CC=CC=C2)N)OC(=O)C)O

InChI

InChI=1S/C22H25NO6/c1-4-22(27,17-11-8-12-18(13-17)28-14(2)24)21(29-15(3)25)19(23)20(26)16-9-6-5-7-10-16/h5-13,19,21,27H,4,23H2,1-3H3