(2S)-1-[2-(1-adamantyl)-2-oxidanylidene-ethyl]-N-(4-methoxyphenyl)carbonyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S)-1-[2-(1-adamantyl)-2-oxidanylidene-ethyl]-N-(4-methoxyphenyl)carbonyl-pyrrolidine-2-carboxamide Openeye Name: (2S)-1-[2-(1-adamantyl)-2-oxo-ethyl]-N-(4-methoxybenzoyl)pyrrolidine-2-carboxamide CAS Name: (2S)-1-[2-(1-adamantyl)-2-oxoethyl]-N-[(4-methoxyphenyl)-oxomethyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-[2-(1-adamantyl)-2-oxoethyl]-N-(4-methoxybenzoyl)pyrrolidine-2-carboxamide Traditional Name: (2S)-1-[2-(1-adamantyl)-2-keto-ethyl]-N-p-anisoyl-pyrrolidine-2-carboxamide Formula: C25H32N2O4 MolecularWeight: 424.53258

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC(=O)C2CCCN2CC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC(=O)[C@@H]2CCCN2CC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H32N2O4/c1-31-20-6-4-19(5-7-20)23(29)26-24(30)21-3-2-8-27(21)15-22(28)25-12-16-9-17(13-25)11-18(10-16)14-25/h4-7,16-18,21H,2-3,8-15H2,1H3,(H,26,29,30)/t16?,17?,18?,21-,25?/m0/s1