4-(2-chloranyl-5-methyl-phenoxy)-N,N-diethyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-(2-chloranyl-5-methyl-phenoxy)-N,N-diethyl-3-nitro-benzenesulfonamide Openeye Name: 4-(2-chloro-5-methyl-phenoxy)-N,N-diethyl-3-nitro-benzenesulfonamide CAS Name: 4-(2-chloro-5-methylphenoxy)-N,N-diethyl-3-nitrobenzenesulfonamide IUPAC Name: 4-(2-chloro-5-methylphenoxy)-N,N-diethyl-3-nitrobenzenesulfonamide Traditional Name: 4-(2-chloro-5-methyl-phenoxy)-N,N-diethyl-3-nitro-benzenesulfonamide Formula: C17H19ClN2O5S MolecularWeight: 398.86116

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OC2=C(C=CC(=C2)C)Cl)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OC2=C(C=CC(=C2)C)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H19ClN2O5S/c1-4-19(5-2)26(23,24)13-7-9-16(15(11-13)20(21)22)25-17-10-12(3)6-8-14(17)18/h6-11H,4-5H2,1-3H3