methyl 4-methyl-3-[3-[3,4,5-tris(oxidanyl)phenyl]propanoylamino]benzoate

Systemtic Name: methyl 4-methyl-3-[3-[3,4,5-tris(oxidanyl)phenyl]propanoylamino]benzoate Openeye Name: methyl 4-methyl-3-[3-(3,4,5-trihydroxyphenyl)propanoylamino]benzoate CAS Name: 4-methyl-3-[[1-oxo-3-(3,4,5-trihydroxyphenyl)propyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[3-(3,4,5-trihydroxyphenyl)propanoylamino]benzoate Traditional Name: 4-methyl-3-[3-(3,4,5-trihydroxyphenyl)propanoylamino]benzoic acid methyl ester Formula: C18H19NO6 MolecularWeight: 345.34656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CCC2=CC(=C(C(=C2)O)O)O

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CCC2=CC(=C(C(=C2)O)O)O

InChI

InChI=1S/C18H19NO6/c1-10-3-5-12(18(24)25-2)9-13(10)19-16(22)6-4-11-7-14(20)17(23)15(21)8-11/h3,5,7-9,20-21,23H,4,6H2,1-2H3,(H,19,22)