N-[3-chloranyl-4-[4-(phenylcarbonyl)piperazin-1-yl]phenyl]oxane-4-carboxamide

Systemtic Name: N-[3-chloranyl-4-[4-(phenylcarbonyl)piperazin-1-yl]phenyl]oxane-4-carboxamide Openeye Name: N-[4-(4-benzoylpiperazin-1-yl)-3-chloro-phenyl]tetrahydropyran-4-carboxamide CAS Name: N-[4-(4-benzoyl-1-piperazinyl)-3-chlorophenyl]-4-oxanecarboxamide IUPAC Name: N-[4-(4-benzoylpiperazin-1-yl)-3-chlorophenyl]oxane-4-carboxamide Traditional Name: N-[4-(4-benzoylpiperazino)-3-chloro-phenyl]tetrahydropyran-4-carboxamide Formula: C23H26ClN3O3 MolecularWeight: 427.92384

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1C(=O)NC2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4)Cl

Isomeric SMILES

C1COCCC1C(=O)NC2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4)Cl

InChI

InChI=1S/C23H26ClN3O3/c24-20-16-19(25-22(28)17-8-14-30-15-9-17)6-7-21(20)26-10-12-27(13-11-26)23(29)18-4-2-1-3-5-18/h1-7,16-17H,8-15H2,(H,25,28)