4-nitro-3-(phenylsulfonylmethyl)benzaldehyde

Systemtic Name: 4-nitro-3-(phenylsulfonylmethyl)benzaldehyde Openeye Name: 3-(benzenesulfonylmethyl)-4-nitro-benzaldehyde CAS Name: 3-(benzenesulfonylmethyl)-4-nitrobenzaldehyde IUPAC Name: 3-(benzenesulfonylmethyl)-4-nitrobenzaldehyde Traditional Name: 3-(besylmethyl)-4-nitro-benzaldehyde Formula: C14H11NO5S MolecularWeight: 305.30584

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)CC2=C(C=CC(=C2)C=O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)CC2=C(C=CC(=C2)C=O)[N+](=O)[O-]

InChI

InChI=1S/C14H11NO5S/c16-9-11-6-7-14(15(17)18)12(8-11)10-21(19,20)13-4-2-1-3-5-13/h1-9H,10H2