N-[2-[4-(5-chloranyl-2-methoxy-phenyl)carbonylpiperazin-1-yl]ethyl]-4-fluoranyl-benzamide

Systemtic Name: N-[2-[4-(5-chloranyl-2-methoxy-phenyl)carbonylpiperazin-1-yl]ethyl]-4-fluoranyl-benzamide Openeye Name: N-[2-[4-(5-chloro-2-methoxy-benzoyl)piperazin-1-yl]ethyl]-4-fluoro-benzamide CAS Name: N-[2-[4-[(5-chloro-2-methoxyphenyl)-oxomethyl]-1-piperazinyl]ethyl]-4-fluorobenzamide IUPAC Name: N-[2-[4-(5-chloro-2-methoxybenzoyl)piperazin-1-yl]ethyl]-4-fluorobenzamide Traditional Name: N-[2-[4-(5-chloro-2-methoxy-benzoyl)piperazino]ethyl]-4-fluoro-benzamide Formula: C21H23ClFN3O3 MolecularWeight: 419.877023

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C(=O)N2CCN(CC2)CCNC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C(=O)N2CCN(CC2)CCNC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H23ClFN3O3/c1-29-19-7-4-16(22)14-18(19)21(28)26-12-10-25(11-13-26)9-8-24-20(27)15-2-5-17(23)6-3-15/h2-7,14H,8-13H2,1H3,(H,24,27)