N-[4-chloranyl-2-(propylcarbamoyl)phenyl]adamantane-1-carboxamide

Systemtic Name: N-[4-chloranyl-2-(propylcarbamoyl)phenyl]adamantane-1-carboxamide Openeye Name: N-[4-chloro-2-(propylcarbamoyl)phenyl]adamantane-1-carboxamide CAS Name: N-[4-chloro-2-[oxo(propylamino)methyl]phenyl]-1-adamantanecarboxamide IUPAC Name: N-[4-chloro-2-(propylcarbamoyl)phenyl]adamantane-1-carboxamide Traditional Name: N-[4-chloro-2-(propylcarbamoyl)phenyl]adamantane-1-carboxamide Formula: C21H27ClN2O2 MolecularWeight: 374.90428

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=C(C=CC(=C1)Cl)NC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCCNC(=O)C1=C(C=CC(=C1)Cl)NC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C21H27ClN2O2/c1-2-5-23-19(25)17-9-16(22)3-4-18(17)24-20(26)21-10-13-6-14(11-21)8-15(7-13)12-21/h3-4,9,13-15H,2,5-8,10-12H2,1H3,(H,23,25)(H,24,26)