4-[(2S)-2-(4-fluoranyl-3-methyl-phenyl)-2-oxidanyl-propyl]piperazine-1-carbaldehyde

Systemtic Name: 4-[(2S)-2-(4-fluoranyl-3-methyl-phenyl)-2-oxidanyl-propyl]piperazine-1-carbaldehyde Openeye Name: 4-[(2S)-2-(4-fluoro-3-methyl-phenyl)-2-hydroxy-propyl]piperazine-1-carbaldehyde CAS Name: 4-[(2S)-2-(4-fluoro-3-methylphenyl)-2-hydroxypropyl]-1-piperazinecarboxaldehyde IUPAC Name: 4-[(2S)-2-(4-fluoro-3-methylphenyl)-2-hydroxypropyl]piperazine-1-carbaldehyde Traditional Name: 4-[(2S)-2-(4-fluoro-3-methyl-phenyl)-2-hydroxy-propyl]piperazine-1-carbaldehyde Formula: C15H21FN2O2 MolecularWeight: 280.337843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(C)(CN2CCN(CC2)C=O)O)F

Isomeric SMILES

CC1=C(C=CC(=C1)[C@@](C)(CN2CCN(CC2)C=O)O)F

InChI

InChI=1S/C15H21FN2O2/c1-12-9-13(3-4-14(12)16)15(2,20)10-17-5-7-18(11-19)8-6-17/h3-4,9,11,20H,5-8,10H2,1-2H3/t15-/m1/s1