N-(2,6-dimethylphenyl)-2-[4-(3-fluoranyl-4-methoxy-phenyl)carbonylpiperazin-1-yl]ethanamide

Systemtic Name: N-(2,6-dimethylphenyl)-2-[4-(3-fluoranyl-4-methoxy-phenyl)carbonylpiperazin-1-yl]ethanamide Openeye Name: N-(2,6-dimethylphenyl)-2-[4-(3-fluoro-4-methoxy-benzoyl)piperazin-1-yl]acetamide CAS Name: N-(2,6-dimethylphenyl)-2-[4-[(3-fluoro-4-methoxyphenyl)-oxomethyl]-1-piperazinyl]acetamide IUPAC Name: N-(2,6-dimethylphenyl)-2-[4-(3-fluoro-4-methoxybenzoyl)piperazin-1-yl]acetamide Traditional Name: N-(2,6-dimethylphenyl)-2-[4-(3-fluoro-4-methoxy-benzoyl)piperazino]acetamide Formula: C22H26FN3O3 MolecularWeight: 399.458543

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CN2CCN(CC2)C(=O)C3=CC(=C(C=C3)OC)F

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CN2CCN(CC2)C(=O)C3=CC(=C(C=C3)OC)F

InChI

InChI=1S/C22H26FN3O3/c1-15-5-4-6-16(2)21(15)24-20(27)14-25-9-11-26(12-10-25)22(28)17-7-8-19(29-3)18(23)13-17/h4-8,13H,9-12,14H2,1-3H3,(H,24,27)