2-methyl-N-[(1-methylimidazol-2-yl)-phenyl-methyl]-3-nitro-benzenesulfonamide

Systemtic Name: 2-methyl-N-[(1-methylimidazol-2-yl)-phenyl-methyl]-3-nitro-benzenesulfonamide Openeye Name: 2-methyl-N-[(1-methylimidazol-2-yl)-phenyl-methyl]-3-nitro-benzenesulfonamide CAS Name: 2-methyl-N-[(1-methyl-2-imidazolyl)-phenylmethyl]-3-nitrobenzenesulfonamide IUPAC Name: 2-methyl-N-[(1-methylimidazol-2-yl)-phenylmethyl]-3-nitrobenzenesulfonamide Traditional Name: 2-methyl-N-[(1-methylimidazol-2-yl)-phenyl-methyl]-3-nitro-benzenesulfonamide Formula: C18H18N4O4S MolecularWeight: 386.42492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1S(=O)(=O)NC(C2=CC=CC=C2)C3=NC=CN3C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC=C1S(=O)(=O)NC(C2=CC=CC=C2)C3=NC=CN3C)[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O4S/c1-13-15(22(23)24)9-6-10-16(13)27(25,26)20-17(14-7-4-3-5-8-14)18-19-11-12-21(18)2/h3-12,17,20H,1-2H3