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

Systemtic Name: 4-[(2S)-2-(4-methoxy-3-methyl-phenyl)-2-oxidanyl-propyl]piperazine-1-carbaldehyde Openeye Name: 4-[(2S)-2-hydroxy-2-(4-methoxy-3-methyl-phenyl)propyl]piperazine-1-carbaldehyde CAS Name: 4-[(2S)-2-hydroxy-2-(4-methoxy-3-methylphenyl)propyl]-1-piperazinecarboxaldehyde IUPAC Name: 4-[(2S)-2-hydroxy-2-(4-methoxy-3-methylphenyl)propyl]piperazine-1-carbaldehyde Traditional Name: 4-[(2S)-2-hydroxy-2-(4-methoxy-3-methyl-phenyl)propyl]piperazine-1-carbaldehyde Formula: C16H24N2O3 MolecularWeight: 292.37336

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24N2O3/c1-13-10-14(4-5-15(13)21-3)16(2,20)11-17-6-8-18(12-19)9-7-17/h4-5,10,12,20H,6-9,11H2,1-3H3/t16-/m1/s1