4-[(E)-3-(4-chloranyl-3-nitro-phenyl)prop-2-enoyl]-N,N-diethyl-benzenesulfonamide

Systemtic Name: 4-[(E)-3-(4-chloranyl-3-nitro-phenyl)prop-2-enoyl]-N,N-diethyl-benzenesulfonamide Openeye Name: 4-[(E)-3-(4-chloro-3-nitro-phenyl)prop-2-enoyl]-N,N-diethyl-benzenesulfonamide CAS Name: 4-[(E)-3-(4-chloro-3-nitrophenyl)-1-oxoprop-2-enyl]-N,N-diethylbenzenesulfonamide IUPAC Name: 4-[(E)-3-(4-chloro-3-nitrophenyl)prop-2-enoyl]-N,N-diethylbenzenesulfonamide Traditional Name: 4-[(E)-3-(4-chloro-3-nitro-phenyl)acryloyl]-N,N-diethyl-benzenesulfonamide Formula: C19H19ClN2O5S MolecularWeight: 422.88256

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19ClN2O5S/c1-3-21(4-2)28(26,27)16-9-7-15(8-10-16)19(23)12-6-14-5-11-17(20)18(13-14)22(24)25/h5-13H,3-4H2,1-2H3/b12-6+