(5S,7R)-3-acetamido-N-[2-(4-methoxyphenoxy)ethyl]adamantane-1-carboxamide

Systemtic Name: (5S,7R)-3-acetamido-N-[2-(4-methoxyphenoxy)ethyl]adamantane-1-carboxamide Openeye Name: (5S,7R)-3-acetamido-N-[2-(4-methoxyphenoxy)ethyl]adamantane-1-carboxamide CAS Name: (5S,7R)-3-acetamido-N-[2-(4-methoxyphenoxy)ethyl]-1-adamantanecarboxamide IUPAC Name: (5S,7R)-3-acetamido-N-[2-(4-methoxyphenoxy)ethyl]adamantane-1-carboxamide Traditional Name: (5S,7R)-3-acetamido-N-[2-(4-methoxyphenoxy)ethyl]adamantane-1-carboxamide Formula: C22H30N2O4 MolecularWeight: 386.4846

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC12CC3CC(C1)CC(C3)(C2)C(=O)NCCOC4=CC=C(C=C4)OC

Isomeric SMILES

CC(=O)NC12C[C@@H]3C[C@H](C1)CC(C3)(C2)C(=O)NCCOC4=CC=C(C=C4)OC

InChI

InChI=1S/C22H30N2O4/c1-15(25)24-22-12-16-9-17(13-22)11-21(10-16,14-22)20(26)23-7-8-28-19-5-3-18(27-2)4-6-19/h3-6,16-17H,7-14H2,1-2H3,(H,23,26)(H,24,25)/t16-,17+,21?,22?