4-chloranyl-N-[(3-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]-2-nitro-benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[(3-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]-2-nitro-benzenesulfonamide Openeye Name: 4-chloro-N-[(3-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]-2-nitro-benzenesulfonamide CAS Name: 4-chloro-N-[(3-methoxyphenyl)-(1-methyl-2-imidazolyl)methyl]-2-nitrobenzenesulfonamide IUPAC Name: 4-chloro-N-[(3-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]-2-nitrobenzenesulfonamide Traditional Name: 4-chloro-N-[(3-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]-2-nitro-benzenesulfonamide Formula: C18H17ClN4O5S MolecularWeight: 436.86938

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(C2=CC(=CC=C2)OC)NS(=O)(=O)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CN1C=CN=C1C(C2=CC(=CC=C2)OC)NS(=O)(=O)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H17ClN4O5S/c1-22-9-8-20-18(22)17(12-4-3-5-14(10-12)28-2)21-29(26,27)16-7-6-13(19)11-15(16)23(24)25/h3-11,17,21H,1-2H3