(5S,7R)-3-chloranyl-N-[2-oxidanylidene-2-(3-propan-2-yloxypropylamino)ethyl]adamantane-1-carboxamide

Systemtic Name: (5S,7R)-3-chloranyl-N-[2-oxidanylidene-2-(3-propan-2-yloxypropylamino)ethyl]adamantane-1-carboxamide Openeye Name: (5S,7R)-3-chloro-N-[2-(3-isopropoxypropylamino)-2-oxo-ethyl]adamantane-1-carboxamide CAS Name: (5S,7R)-3-chloro-N-[2-oxo-2-(3-propan-2-yloxypropylamino)ethyl]-1-adamantanecarboxamide IUPAC Name: (5S,7R)-3-chloro-N-[2-oxo-2-(3-propan-2-yloxypropylamino)ethyl]adamantane-1-carboxamide Traditional Name: (5S,7R)-3-chloro-N-[2-(3-isopropoxypropylamino)-2-keto-ethyl]adamantane-1-carboxamide Formula: C19H31ClN2O3 MolecularWeight: 370.91404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCNC(=O)CNC(=O)C12CC3CC(C1)CC(C3)(C2)Cl

Isomeric SMILES

CC(C)OCCCNC(=O)CNC(=O)C12C[C@H]3C[C@@H](C1)CC(C3)(C2)Cl

InChI

InChI=1S/C19H31ClN2O3/c1-13(2)25-5-3-4-21-16(23)11-22-17(24)18-7-14-6-15(8-18)10-19(20,9-14)12-18/h13-15H,3-12H2,1-2H3,(H,21,23)(H,22,24)/t14-,15+,18?,19?