N,N-diethyl-4-[3-(3-methoxy-5-nitro-4-oxidanyl-phenyl)prop-2-enoyl]benzenesulfonamide

Systemtic Name: N,N-diethyl-4-[3-(3-methoxy-5-nitro-4-oxidanyl-phenyl)prop-2-enoyl]benzenesulfonamide Openeye Name: N,N-diethyl-4-[3-(4-hydroxy-3-methoxy-5-nitro-phenyl)prop-2-enoyl]benzenesulfonamide CAS Name: N,N-diethyl-4-[3-(4-hydroxy-3-methoxy-5-nitrophenyl)-1-oxoprop-2-enyl]benzenesulfonamide IUPAC Name: N,N-diethyl-4-[3-(4-hydroxy-3-methoxy-5-nitrophenyl)prop-2-enoyl]benzenesulfonamide Traditional Name: N,N-diethyl-4-[3-(4-hydroxy-3-methoxy-5-nitro-phenyl)acryloyl]benzenesulfonamide Formula: C20H22N2O7S MolecularWeight: 434.46288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)C=CC2=CC(=C(C(=C2)OC)O)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)C=CC2=CC(=C(C(=C2)OC)O)[N+](=O)[O-]

InChI

InChI=1S/C20H22N2O7S/c1-4-21(5-2)30(27,28)16-9-7-15(8-10-16)18(23)11-6-14-12-17(22(25)26)20(24)19(13-14)29-3/h6-13,24H,4-5H2,1-3H3