2-fluoranyl-N-[(2S)-1-[4-(2-hydroxyphenyl)piperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: 2-fluoranyl-N-[(2S)-1-[4-(2-hydroxyphenyl)piperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: 2-fluoro-N-[(1S)-1-[4-(2-hydroxyphenyl)piperazine-1-carbonyl]-2-methyl-propyl]benzamide CAS Name: 2-fluoro-N-[(2S)-1-[4-(2-hydroxyphenyl)-1-piperazinyl]-3-methyl-1-oxobutan-2-yl]benzamide IUPAC Name: 2-fluoro-N-[(2S)-1-[4-(2-hydroxyphenyl)piperazin-1-yl]-3-methyl-1-oxobutan-2-yl]benzamide Traditional Name: 2-fluoro-N-[(1S)-1-[4-(2-hydroxyphenyl)piperazine-1-carbonyl]-2-methyl-propyl]benzamide Formula: C22H26FN3O3 MolecularWeight: 399.458543

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCN(CC1)C2=CC=CC=C2O)NC(=O)C3=CC=CC=C3F

Isomeric SMILES

CC(C)[C@@H](C(=O)N1CCN(CC1)C2=CC=CC=C2O)NC(=O)C3=CC=CC=C3F

InChI

InChI=1S/C22H26FN3O3/c1-15(2)20(24-21(28)16-7-3-4-8-17(16)23)22(29)26-13-11-25(12-14-26)18-9-5-6-10-19(18)27/h3-10,15,20,27H,11-14H2,1-2H3,(H,24,28)/t20-/m0/s1