[2-(1-adamantylamino)-2-oxidanylidene-ethyl] 3,4-bis(oxidanyl)benzoate

Systemtic Name: [2-(1-adamantylamino)-2-oxidanylidene-ethyl] 3,4-bis(oxidanyl)benzoate Openeye Name: [2-(1-adamantylamino)-2-oxo-ethyl] 3,4-dihydroxybenzoate CAS Name: 3,4-dihydroxybenzoic acid [2-(1-adamantylamino)-2-oxoethyl] ester IUPAC Name: [2-(1-adamantylamino)-2-oxoethyl] 3,4-dihydroxybenzoate Traditional Name: 3,4-dihydroxybenzoic acid [2-(1-adamantylamino)-2-keto-ethyl] ester Formula: C19H23NO5 MolecularWeight: 345.38962

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)COC(=O)C4=CC(=C(C=C4)O)O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)COC(=O)C4=CC(=C(C=C4)O)O

InChI

InChI=1S/C19H23NO5/c21-15-2-1-14(6-16(15)22)18(24)25-10-17(23)20-19-7-11-3-12(8-19)5-13(4-11)9-19/h1-2,6,11-13,21-22H,3-5,7-10H2,(H,20,23)