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(5S,7R)-3-acetamido-N-(4-phenoxybutyl)adamantane-1-carboxamide

(5S,7R)-3-acetamido-N-(4-phenoxybutyl)adamantane-1-carboxamide

Systemtic Name:(5S,7R)-3-acetamido-N-(4-phenoxybutyl)adamantane-1-carboxamide
Openeye Name:(5S,7R)-3-acetamido-N-(4-phenoxybutyl)adamantane-1-carboxamide
CAS Name:(5S,7R)-3-acetamido-N-(4-phenoxybutyl)-1-adamantanecarboxamide
IUPAC Name:(5S,7R)-3-acetamido-N-(4-phenoxybutyl)adamantane-1-carboxamide
Traditional Name:(5S,7R)-3-acetamido-N-(4-phenoxybutyl)adamantane-1-carboxamide
Formula: C23H32N2O3
MolecularWeight: 384.51178
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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC12CC3CC(C1)CC(C3)(C2)C(=O)NCCCCOC4=CC=CC=C4


Isomeric SMILES

CC(=O)NC12C[C@@H]3C[C@H](C1)CC(C3)(C2)C(=O)NCCCCOC4=CC=CC=C4


InChI

InChI=1S/C23H32N2O3/c1-17(26)25-23-14-18-11-19(15-23)13-22(12-18,16-23)21(27)24-9-5-6-10-28-20-7-3-2-4-8-20/h2-4,7-8,18-19H,5-6,9-16H2,1H3,(H,24,27)(H,25,26)/t18-,19+,22?,23?


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