5-nitro-2-octan-2-yloxy-benzaldehyde

Systemtic Name: 5-nitro-2-octan-2-yloxy-benzaldehyde Openeye Name: 2-(1-methylheptoxy)-5-nitro-benzaldehyde CAS Name: 5-nitro-2-octan-2-yloxybenzaldehyde IUPAC Name: 5-nitro-2-octan-2-yloxybenzaldehyde Traditional Name: 2-(1-methylheptoxy)-5-nitro-benzaldehyde Formula: C15H21NO4 MolecularWeight: 279.33154

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC1=C(C=C(C=C1)[N+](=O)[O-])C=O

Isomeric SMILES

CCCCCCC(C)OC1=C(C=C(C=C1)[N+](=O)[O-])C=O

InChI

InChI=1S/C15H21NO4/c1-3-4-5-6-7-12(2)20-15-9-8-14(16(18)19)10-13(15)11-17/h8-12H,3-7H2,1-2H3