2-[(7-cyanonaphthalen-2-yl)methyl]-4-nitro-benzenesulfonamide

Systemtic Name: 2-[(7-cyanonaphthalen-2-yl)methyl]-4-nitro-benzenesulfonamide Openeye Name: 2-[(7-cyano-2-naphthyl)methyl]-4-nitro-benzenesulfonamide CAS Name: 2-[(7-cyano-2-naphthalenyl)methyl]-4-nitrobenzenesulfonamide IUPAC Name: 2-[(7-cyanonaphthalen-2-yl)methyl]-4-nitrobenzenesulfonamide Traditional Name: 2-[(7-cyano-2-naphthyl)methyl]-4-nitro-benzenesulfonamide Formula: C18H13N3O4S MolecularWeight: 367.37852

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC2=C1C=CC(=C2)C#N)CC3=C(C=CC(=C3)[N+](=O)[O-])S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC2=C1C=CC(=C2)C#N)CC3=C(C=CC(=C3)[N+](=O)[O-])S(=O)(=O)N

InChI

InChI=1S/C18H13N3O4S/c19-11-13-2-4-14-3-1-12(7-15(14)9-13)8-16-10-17(21(22)23)5-6-18(16)26(20,24)25/h1-7,9-10H,8H2,(H2,20,24,25)