[2-(1-adamantylamino)-2-oxidanylidene-ethyl] 2-phenylazanylbenzoate

Systemtic Name: [2-(1-adamantylamino)-2-oxidanylidene-ethyl] 2-phenylazanylbenzoate Openeye Name: [2-(1-adamantylamino)-2-oxo-ethyl] 2-anilinobenzoate CAS Name: 2-anilinobenzoic acid [2-(1-adamantylamino)-2-oxoethyl] ester IUPAC Name: [2-(1-adamantylamino)-2-oxoethyl] 2-anilinobenzoate Traditional Name: 2-anilinobenzoic acid [2-(1-adamantylamino)-2-keto-ethyl] ester Formula: C25H28N2O3 MolecularWeight: 404.50142

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)COC(=O)C4=CC=CC=C4NC5=CC=CC=C5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)COC(=O)C4=CC=CC=C4NC5=CC=CC=C5

InChI

InChI=1S/C25H28N2O3/c28-23(27-25-13-17-10-18(14-25)12-19(11-17)15-25)16-30-24(29)21-8-4-5-9-22(21)26-20-6-2-1-3-7-20/h1-9,17-19,26H,10-16H2,(H,27,28)