N-[3-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]-3-oxidanylidene-propyl]adamantane-1-carboxamide

Systemtic Name: N-[3-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]-3-oxidanylidene-propyl]adamantane-1-carboxamide Openeye Name: N-[3-[4-(4-fluorobenzoyl)piperazin-1-yl]-3-oxo-propyl]adamantane-1-carboxamide CAS Name: N-[3-[4-[(4-fluorophenyl)-oxomethyl]-1-piperazinyl]-3-oxopropyl]-1-adamantanecarboxamide IUPAC Name: N-[3-[4-(4-fluorobenzoyl)piperazin-1-yl]-3-oxopropyl]adamantane-1-carboxamide Traditional Name: N-[3-[4-(4-fluorobenzoyl)piperazino]-3-keto-propyl]adamantane-1-carboxamide Formula: C25H32FN3O3 MolecularWeight: 441.538283

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCNC(=O)C23CC4CC(C2)CC(C4)C3)C(=O)C5=CC=C(C=C5)F

Isomeric SMILES

C1CN(CCN1C(=O)CCNC(=O)C23CC4CC(C2)CC(C4)C3)C(=O)C5=CC=C(C=C5)F

InChI

InChI=1S/C25H32FN3O3/c26-21-3-1-20(2-4-21)23(31)29-9-7-28(8-10-29)22(30)5-6-27-24(32)25-14-17-11-18(15-25)13-19(12-17)16-25/h1-4,17-19H,5-16H2,(H,27,32)