bis[2-(1-adamantylamino)-2-oxidanylidene-ethyl] (E)-but-2-enedioate

Systemtic Name: bis[2-(1-adamantylamino)-2-oxidanylidene-ethyl] (E)-but-2-enedioate Openeye Name: bis[2-(1-adamantylamino)-2-oxo-ethyl] (E)-but-2-enedioate CAS Name: (E)-2-butenedioic acid bis[2-(1-adamantylamino)-2-oxoethyl] ester IUPAC Name: bis[2-(1-adamantylamino)-2-oxoethyl] (E)-but-2-enedioate Traditional Name: (E)-but-2-enedioic acid bis[2-(1-adamantylamino)-2-keto-ethyl] ester Formula: C28H38N2O6 MolecularWeight: 498.61112

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)COC(=O)C=CC(=O)OCC(=O)NC45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)COC(=O)/C=C/C(=O)OCC(=O)NC45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C28H38N2O6/c31-23(29-27-9-17-3-18(10-27)5-19(4-17)11-27)15-35-25(33)1-2-26(34)36-16-24(32)30-28-12-20-6-21(13-28)8-22(7-20)14-28/h1-2,17-22H,3-16H2,(H,29,31)(H,30,32)/b2-1+