N-[1-(naphthalen-1-ylmethyl)pyrazol-3-yl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[1-(naphthalen-1-ylmethyl)pyrazol-3-yl]-4-nitro-benzenesulfonamide Openeye Name: N-[1-(1-naphthylmethyl)pyrazol-3-yl]-4-nitro-benzenesulfonamide CAS Name: N-[1-(1-naphthalenylmethyl)-3-pyrazolyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[1-(naphthalen-1-ylmethyl)pyrazol-3-yl]-4-nitrobenzenesulfonamide Traditional Name: N-[1-(1-naphthylmethyl)pyrazol-3-yl]-4-nitro-benzenesulfonamide Formula: C20H16N4O4S MolecularWeight: 408.43044

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CN3C=CC(=N3)NS(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CN3C=CC(=N3)NS(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H16N4O4S/c25-24(26)17-8-10-18(11-9-17)29(27,28)22-20-12-13-23(21-20)14-16-6-3-5-15-4-1-2-7-19(15)16/h1-13H,14H2,(H,21,22)