N-(5-chloranyl-2-methoxy-phenyl)-3-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]propanamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-3-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]propanamide Openeye Name: N-(5-chloro-2-methoxy-phenyl)-3-[4-(4-fluorobenzoyl)piperazin-1-yl]propanamide CAS Name: N-(5-chloro-2-methoxyphenyl)-3-[4-[(4-fluorophenyl)-oxomethyl]-1-piperazinyl]propanamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-3-[4-(4-fluorobenzoyl)piperazin-1-yl]propanamide Traditional Name: N-(5-chloro-2-methoxy-phenyl)-3-[4-(4-fluorobenzoyl)piperazino]propionamide Formula: C21H23ClFN3O3 MolecularWeight: 419.877023

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=O)CCN2CCN(CC2)C(=O)C3=CC=C(C=C3)F

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=O)CCN2CCN(CC2)C(=O)C3=CC=C(C=C3)F

InChI

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