N-[4-(4-pentanoylpiperazin-1-yl)phenyl]adamantane-1-carboxamide

Systemtic Name: N-[4-(4-pentanoylpiperazin-1-yl)phenyl]adamantane-1-carboxamide Openeye Name: N-[4-(4-pentanoylpiperazin-1-yl)phenyl]adamantane-1-carboxamide CAS Name: N-[4-[4-(1-oxopentyl)-1-piperazinyl]phenyl]-1-adamantanecarboxamide IUPAC Name: N-[4-(4-pentanoylpiperazin-1-yl)phenyl]adamantane-1-carboxamide Traditional Name: N-[4-(4-valerylpiperazino)phenyl]adamantane-1-carboxamide Formula: C26H37N3O2 MolecularWeight: 423.59088

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C26H37N3O2/c1-2-3-4-24(30)29-11-9-28(10-12-29)23-7-5-22(6-8-23)27-25(31)26-16-19-13-20(17-26)15-21(14-19)18-26/h5-8,19-21H,2-4,9-18H2,1H3,(H,27,31)