2-nitro-5-[3-(phenylsulfonyl)propoxy]benzaldehyde

Systemtic Name: 2-nitro-5-[3-(phenylsulfonyl)propoxy]benzaldehyde Openeye Name: 5-[3-(benzenesulfonyl)propoxy]-2-nitro-benzaldehyde CAS Name: 5-[3-(benzenesulfonyl)propoxy]-2-nitrobenzaldehyde IUPAC Name: 5-[3-(benzenesulfonyl)propoxy]-2-nitrobenzaldehyde Traditional Name: 5-(3-besylpropoxy)-2-nitro-benzaldehyde Formula: C16H15NO6S MolecularWeight: 349.3584

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)CCCOC2=CC(=C(C=C2)[N+](=O)[O-])C=O

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)CCCOC2=CC(=C(C=C2)[N+](=O)[O-])C=O

InChI

InChI=1S/C16H15NO6S/c18-12-13-11-14(7-8-16(13)17(19)20)23-9-4-10-24(21,22)15-5-2-1-3-6-15/h1-3,5-8,11-12H,4,9-10H2