(5S,7R)-3-acetamido-N-[3-(3-methylphenoxy)propyl]adamantane-1-carboxamide

Systemtic Name: (5S,7R)-3-acetamido-N-[3-(3-methylphenoxy)propyl]adamantane-1-carboxamide Openeye Name: (5S,7R)-3-acetamido-N-[3-(3-methylphenoxy)propyl]adamantane-1-carboxamide CAS Name: (5S,7R)-3-acetamido-N-[3-(3-methylphenoxy)propyl]-1-adamantanecarboxamide IUPAC Name: (5S,7R)-3-acetamido-N-[3-(3-methylphenoxy)propyl]adamantane-1-carboxamide Traditional Name: (5S,7R)-3-acetamido-N-[3-(3-methylphenoxy)propyl]adamantane-1-carboxamide Formula: C23H32N2O3 MolecularWeight: 384.51178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCCNC(=O)C23CC4CC(C2)CC(C4)(C3)NC(=O)C

Isomeric SMILES

CC1=CC(=CC=C1)OCCCNC(=O)C23C[C@H]4C[C@@H](C2)CC(C4)(C3)NC(=O)C

InChI

InChI=1S/C23H32N2O3/c1-16-5-3-6-20(9-16)28-8-4-7-24-21(27)22-11-18-10-19(12-22)14-23(13-18,15-22)25-17(2)26/h3,5-6,9,18-19H,4,7-8,10-15H2,1-2H3,(H,24,27)(H,25,26)/t18-,19+,22?,23?