N-[3-(2-dimethylaminoethyloxy)-4-iodanyl-phenyl]-3-nitro-benzenesulfonamide

Systemtic Name: N-[3-(2-dimethylaminoethyloxy)-4-iodanyl-phenyl]-3-nitro-benzenesulfonamide Openeye Name: N-[3-(2-dimethylaminoethyloxy)-4-iodo-phenyl]-3-nitro-benzenesulfonamide CAS Name: N-[3-(2-dimethylaminoethyloxy)-4-iodophenyl]-3-nitrobenzenesulfonamide IUPAC Name: N-[3-(2-dimethylaminoethyloxy)-4-iodophenyl]-3-nitrobenzenesulfonamide Traditional Name: N-[3-(2-dimethylaminoethyloxy)-4-iodo-phenyl]-3-nitro-benzenesulfonamide Formula: C16H18IN3O5S MolecularWeight: 491.30069

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCOC1=C(C=CC(=C1)NS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])I

Isomeric SMILES

CN(C)CCOC1=C(C=CC(=C1)NS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])I

InChI

InChI=1S/C16H18IN3O5S/c1-19(2)8-9-25-16-10-12(6-7-15(16)17)18-26(23,24)14-5-3-4-13(11-14)20(21)22/h3-7,10-11,18H,8-9H2,1-2H3