methyl 6-(2-methoxy-2-oxidanylidene-ethyl)-3-(octylcarbamoyl)-2,4-bis(oxidanyl)benzoate

Systemtic Name: methyl 6-(2-methoxy-2-oxidanylidene-ethyl)-3-(octylcarbamoyl)-2,4-bis(oxidanyl)benzoate Openeye Name: methyl 2,4-dihydroxy-6-(2-methoxy-2-oxo-ethyl)-3-(octylcarbamoyl)benzoate CAS Name: 2,4-dihydroxy-6-(2-methoxy-2-oxoethyl)-3-[(octylamino)-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 2,4-dihydroxy-6-(2-methoxy-2-oxoethyl)-3-(octylcarbamoyl)benzoate Traditional Name: 2,4-dihydroxy-6-(2-keto-2-methoxy-ethyl)-3-(octylcarbamoyl)benzoic acid methyl ester Formula: C20H29NO7 MolecularWeight: 395.44676

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=O)C1=C(C=C(C(=C1O)C(=O)OC)CC(=O)OC)O

Isomeric SMILES

CCCCCCCCNC(=O)C1=C(C=C(C(=C1O)C(=O)OC)CC(=O)OC)O

InChI

InChI=1S/C20H29NO7/c1-4-5-6-7-8-9-10-21-19(25)17-14(22)11-13(12-15(23)27-2)16(18(17)24)20(26)28-3/h11,22,24H,4-10,12H2,1-3H3,(H,21,25)