N-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]naphthalene-1-sulfonamide

Systemtic Name: N-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]naphthalene-1-sulfonamide Openeye Name: N-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]naphthalene-1-sulfonamide CAS Name: N-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]-1-naphthalenesulfonamide IUPAC Name: N-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]naphthalene-1-sulfonamide Traditional Name: N-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]naphthalene-1-sulfonamide Formula: C19H18N2O6S2 MolecularWeight: 434.48602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1S(=O)(=O)C[N+](=O)[O-])C)NS(=O)(=O)C2=CC=CC3=CC=CC=C32

Isomeric SMILES

CC1=CC(=CC(=C1S(=O)(=O)C[N+](=O)[O-])C)NS(=O)(=O)C2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C19H18N2O6S2/c1-13-10-16(11-14(2)19(13)28(24,25)12-21(22)23)20-29(26,27)18-9-5-7-15-6-3-4-8-17(15)18/h3-11,20H,12H2,1-2H3