4-chloranyl-N-[(4-ethoxy-3-methoxy-phenyl)methyl]-N-methyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[(4-ethoxy-3-methoxy-phenyl)methyl]-N-methyl-3-nitro-benzenesulfonamide Openeye Name: 4-chloro-N-[(4-ethoxy-3-methoxy-phenyl)methyl]-N-methyl-3-nitro-benzenesulfonamide CAS Name: 4-chloro-N-[(4-ethoxy-3-methoxyphenyl)methyl]-N-methyl-3-nitrobenzenesulfonamide IUPAC Name: 4-chloro-N-[(4-ethoxy-3-methoxyphenyl)methyl]-N-methyl-3-nitrobenzenesulfonamide Traditional Name: 4-chloro-N-(4-ethoxy-3-methoxy-benzyl)-N-methyl-3-nitro-benzenesulfonamide Formula: C17H19ClN2O6S MolecularWeight: 414.86056

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CN(C)S(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CN(C)S(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])OC

InChI

InChI=1S/C17H19ClN2O6S/c1-4-26-16-8-5-12(9-17(16)25-3)11-19(2)27(23,24)13-6-7-14(18)15(10-13)20(21)22/h5-10H,4,11H2,1-3H3