N-(3-chlorophenyl)-3-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]propanamide

Systemtic Name: N-(3-chlorophenyl)-3-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]propanamide Openeye Name: N-(3-chlorophenyl)-3-[4-[(3-fluoro-4-methoxy-phenyl)methyl]piperazin-1-yl]propanamide CAS Name: N-(3-chlorophenyl)-3-[4-[(3-fluoro-4-methoxyphenyl)methyl]-1-piperazinyl]propanamide IUPAC Name: N-(3-chlorophenyl)-3-[4-[(3-fluoro-4-methoxyphenyl)methyl]piperazin-1-yl]propanamide Traditional Name: N-(3-chlorophenyl)-3-[4-(3-fluoro-4-methoxy-benzyl)piperazino]propionamide Formula: C21H25ClFN3O2 MolecularWeight: 405.893503

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCN(CC2)CCC(=O)NC3=CC(=CC=C3)Cl)F

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCN(CC2)CCC(=O)NC3=CC(=CC=C3)Cl)F

InChI

InChI=1S/C21H25ClFN3O2/c1-28-20-6-5-16(13-19(20)23)15-26-11-9-25(10-12-26)8-7-21(27)24-18-4-2-3-17(22)14-18/h2-6,13-14H,7-12,15H2,1H3,(H,24,27)