N-[[4-[2-(3-fluoranylphenoxy)ethylcarbamoyl]phenyl]methyl]adamantane-1-carboxamide

Systemtic Name: N-[[4-[2-(3-fluoranylphenoxy)ethylcarbamoyl]phenyl]methyl]adamantane-1-carboxamide Openeye Name: N-[[4-[2-(3-fluorophenoxy)ethylcarbamoyl]phenyl]methyl]adamantane-1-carboxamide CAS Name: N-[[4-[[2-(3-fluorophenoxy)ethylamino]-oxomethyl]phenyl]methyl]-1-adamantanecarboxamide IUPAC Name: N-[[4-[2-(3-fluorophenoxy)ethylcarbamoyl]phenyl]methyl]adamantane-1-carboxamide Traditional Name: N-[4-[2-(3-fluorophenoxy)ethylcarbamoyl]benzyl]adamantane-1-carboxamide Formula: C27H31FN2O3 MolecularWeight: 450.545043

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NCC4=CC=C(C=C4)C(=O)NCCOC5=CC(=CC=C5)F

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NCC4=CC=C(C=C4)C(=O)NCCOC5=CC(=CC=C5)F

InChI

InChI=1S/C27H31FN2O3/c28-23-2-1-3-24(13-23)33-9-8-29-25(31)22-6-4-18(5-7-22)17-30-26(32)27-14-19-10-20(15-27)12-21(11-19)16-27/h1-7,13,19-21H,8-12,14-17H2,(H,29,31)(H,30,32)