[2-(1-adamantylcarbamoylamino)-2-oxidanylidene-ethyl] 4-methanoylbenzoate

Systemtic Name: [2-(1-adamantylcarbamoylamino)-2-oxidanylidene-ethyl] 4-methanoylbenzoate Openeye Name: [2-(1-adamantylcarbamoylamino)-2-oxo-ethyl] 4-formylbenzoate CAS Name: 4-formylbenzoic acid [2-[[(1-adamantylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(1-adamantylcarbamoylamino)-2-oxoethyl] 4-formylbenzoate Traditional Name: 4-formylbenzoic acid [2-(1-adamantylcarbamoylamino)-2-keto-ethyl] ester Formula: C21H24N2O5 MolecularWeight: 384.42566

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N2O5/c24-11-13-1-3-17(4-2-13)19(26)28-12-18(25)22-20(27)23-21-8-14-5-15(9-21)7-16(6-14)10-21/h1-4,11,14-16H,5-10,12H2,(H2,22,23,25,27)