2-nitro-4-octan-2-yloxy-benzaldehyde

Systemtic Name: 2-nitro-4-octan-2-yloxy-benzaldehyde Openeye Name: 4-(1-methylheptoxy)-2-nitro-benzaldehyde CAS Name: 2-nitro-4-octan-2-yloxybenzaldehyde IUPAC Name: 2-nitro-4-octan-2-yloxybenzaldehyde Traditional Name: 4-(1-methylheptoxy)-2-nitro-benzaldehyde Formula: C15H21NO4 MolecularWeight: 279.33154

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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