N-[1-[(3-chloranylphenoxy)methyl]pyrazol-4-yl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[1-[(3-chloranylphenoxy)methyl]pyrazol-4-yl]-4-nitro-benzenesulfonamide Openeye Name: N-[1-[(3-chlorophenoxy)methyl]pyrazol-4-yl]-4-nitro-benzenesulfonamide CAS Name: N-[1-[(3-chlorophenoxy)methyl]-4-pyrazolyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[1-[(3-chlorophenoxy)methyl]pyrazol-4-yl]-4-nitrobenzenesulfonamide Traditional Name: N-[1-[(3-chlorophenoxy)methyl]pyrazol-4-yl]-4-nitro-benzenesulfonamide Formula: C16H13ClN4O5S MolecularWeight: 408.81622

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)OCN2C=C(C=N2)NS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)Cl)OCN2C=C(C=N2)NS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H13ClN4O5S/c17-12-2-1-3-15(8-12)26-11-20-10-13(9-18-20)19-27(24,25)16-6-4-14(5-7-16)21(22)23/h1-10,19H,11H2