3-tert-butyl-4-oxidanyl-3-[3-(piperidin-1-ylmethyl)phenyl]-2H-thiophene-2-carbaldehyde

Systemtic Name: 3-tert-butyl-4-oxidanyl-3-[3-(piperidin-1-ylmethyl)phenyl]-2H-thiophene-2-carbaldehyde Openeye Name: 3-tert-butyl-4-hydroxy-3-[3-(1-piperidylmethyl)phenyl]-2H-thiophene-2-carbaldehyde CAS Name: 3-tert-butyl-4-hydroxy-3-[3-(1-piperidinylmethyl)phenyl]-2H-thiophene-2-carboxaldehyde IUPAC Name: 3-tert-butyl-4-hydroxy-3-[3-(piperidin-1-ylmethyl)phenyl]-2H-thiophene-2-carbaldehyde Traditional Name: 3-tert-butyl-4-hydroxy-3-[3-(piperidinomethyl)phenyl]-2H-thiophene-2-carbaldehyde Formula: C21H29NO2S MolecularWeight: 359.52546

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1(C(SC=C1O)C=O)C2=CC(=CC=C2)CN3CCCCC3

Isomeric SMILES

CC(C)(C)C1(C(SC=C1O)C=O)C2=CC(=CC=C2)CN3CCCCC3

InChI

InChI=1S/C21H29NO2S/c1-20(2,3)21(18(24)15-25-19(21)14-23)17-9-7-8-16(12-17)13-22-10-5-4-6-11-22/h7-9,12,14-15,19,24H,4-6,10-11,13H2,1-3H3