4-(4-methylpentoxy)-3-nitro-benzaldehyde

Systemtic Name: 4-(4-methylpentoxy)-3-nitro-benzaldehyde Openeye Name: 4-isohexyloxy-3-nitro-benzaldehyde CAS Name: 4-(4-methylpentoxy)-3-nitrobenzaldehyde IUPAC Name: 4-(4-methylpentoxy)-3-nitrobenzaldehyde Traditional Name: 4-isohexyloxy-3-nitro-benzaldehyde Formula: C13H17NO4 MolecularWeight: 251.27838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCOC1=C(C=C(C=C1)C=O)[N+](=O)[O-]

Isomeric SMILES

CC(C)CCCOC1=C(C=C(C=C1)C=O)[N+](=O)[O-]

InChI

InChI=1S/C13H17NO4/c1-10(2)4-3-7-18-13-6-5-11(9-15)8-12(13)14(16)17/h5-6,8-10H,3-4,7H2,1-2H3