(3S)-N-[(1R)-1-(1-adamantyl)ethyl]-5-oxidanylidene-1-phenethyl-pyrrolidine-3-carboxamide

Systemtic Name: (3S)-N-[(1R)-1-(1-adamantyl)ethyl]-5-oxidanylidene-1-phenethyl-pyrrolidine-3-carboxamide Openeye Name: (3S)-N-[(1R)-1-(1-adamantyl)ethyl]-5-oxo-1-phenethyl-pyrrolidine-3-carboxamide CAS Name: (3S)-N-[(1R)-1-(1-adamantyl)ethyl]-5-oxo-1-phenethyl-3-pyrrolidinecarboxamide IUPAC Name: (3S)-N-[(1R)-1-(1-adamantyl)ethyl]-5-oxo-1-phenethylpyrrolidine-3-carboxamide Traditional Name: (3S)-N-[(1R)-1-(1-adamantyl)ethyl]-5-keto-1-phenethyl-pyrrolidine-3-carboxamide Formula: C25H34N2O2 MolecularWeight: 394.54966

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Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)C4CC(=O)N(C4)CCC5=CC=CC=C5

Isomeric SMILES

C[C@H](C12CC3CC(C1)CC(C3)C2)NC(=O)[C@H]4CC(=O)N(C4)CCC5=CC=CC=C5

InChI

InChI=1S/C25H34N2O2/c1-17(25-13-19-9-20(14-25)11-21(10-19)15-25)26-24(29)22-12-23(28)27(16-22)8-7-18-5-3-2-4-6-18/h2-6,17,19-22H,7-16H2,1H3,(H,26,29)/t17-,19?,20?,21?,22+,25?/m1/s1