2-(1,3-benzoxazol-2-ylsulfanyl)cyclohexene-1-carbaldehyde

Systemtic Name: 2-(1,3-benzoxazol-2-ylsulfanyl)cyclohexene-1-carbaldehyde Openeye Name: 2-(1,3-benzoxazol-2-ylsulfanyl)cyclohexene-1-carbaldehyde CAS Name: 2-(1,3-benzoxazol-2-ylthio)-1-cyclohexenecarboxaldehyde IUPAC Name: 2-(1,3-benzoxazol-2-ylsulfanyl)cyclohexene-1-carbaldehyde Traditional Name: 2-(1,3-benzoxazol-2-ylthio)cyclohexene-1-carbaldehyde Formula: C14H13NO2S MolecularWeight: 259.32352

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=C(C1)C=O)SC2=NC3=CC=CC=C3O2

Isomeric SMILES

C1CCC(=C(C1)C=O)SC2=NC3=CC=CC=C3O2

InChI

InChI=1S/C14H13NO2S/c16-9-10-5-1-4-8-13(10)18-14-15-11-6-2-3-7-12(11)17-14/h2-3,6-7,9H,1,4-5,8H2