[2-(cyclohexylmethylamino)-2-oxidanylidene-ethyl] 3,4,5-tris(oxidanyl)benzoate

Systemtic Name: [2-(cyclohexylmethylamino)-2-oxidanylidene-ethyl] 3,4,5-tris(oxidanyl)benzoate Openeye Name: [2-(cyclohexylmethylamino)-2-oxo-ethyl] 3,4,5-trihydroxybenzoate CAS Name: 3,4,5-trihydroxybenzoic acid [2-(cyclohexylmethylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclohexylmethylamino)-2-oxoethyl] 3,4,5-trihydroxybenzoate Traditional Name: 3,4,5-trihydroxybenzoic acid [2-(cyclohexylmethylamino)-2-keto-ethyl] ester Formula: C16H21NO6 MolecularWeight: 323.34104

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CNC(=O)COC(=O)C2=CC(=C(C(=C2)O)O)O

Isomeric SMILES

C1CCC(CC1)CNC(=O)COC(=O)C2=CC(=C(C(=C2)O)O)O

InChI

InChI=1S/C16H21NO6/c18-12-6-11(7-13(19)15(12)21)16(22)23-9-14(20)17-8-10-4-2-1-3-5-10/h6-7,10,18-19,21H,1-5,8-9H2,(H,17,20)