2-decylsulfanyl-5-nitro-benzaldehyde

Systemtic Name: 2-decylsulfanyl-5-nitro-benzaldehyde Openeye Name: 2-decylsulfanyl-5-nitro-benzaldehyde CAS Name: 2-(decylthio)-5-nitrobenzaldehyde IUPAC Name: 2-decylsulfanyl-5-nitrobenzaldehyde Traditional Name: 2-(decylthio)-5-nitro-benzaldehyde Formula: C17H25NO3S MolecularWeight: 323.4503

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCSC1=C(C=C(C=C1)[N+](=O)[O-])C=O

Isomeric SMILES

CCCCCCCCCCSC1=C(C=C(C=C1)[N+](=O)[O-])C=O

InChI

InChI=1S/C17H25NO3S/c1-2-3-4-5-6-7-8-9-12-22-17-11-10-16(18(20)21)13-15(17)14-19/h10-11,13-14H,2-9,12H2,1H3