2-[[4-chloranyl-3-(trifluoromethyl)phenyl]sulfonyl-prop-2-enyl-amino]-N-(3-nitrophenyl)ethanamide

Systemtic Name: 2-[[4-chloranyl-3-(trifluoromethyl)phenyl]sulfonyl-prop-2-enyl-amino]-N-(3-nitrophenyl)ethanamide Openeye Name: 2-[allyl-[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-amino]-N-(3-nitrophenyl)acetamide CAS Name: 2-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-prop-2-enylamino]-N-(3-nitrophenyl)acetamide IUPAC Name: 2-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-prop-2-enylamino]-N-(3-nitrophenyl)acetamide Traditional Name: 2-[allyl-[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-amino]-N-(3-nitrophenyl)acetamide Formula: C18H15ClF3N3O5S MolecularWeight: 477.84201

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC(=O)NC1=CC(=CC=C1)[N+](=O)[O-])S(=O)(=O)C2=CC(=C(C=C2)Cl)C(F)(F)F

Isomeric SMILES

C=CCN(CC(=O)NC1=CC(=CC=C1)[N+](=O)[O-])S(=O)(=O)C2=CC(=C(C=C2)Cl)C(F)(F)F

InChI

InChI=1S/C18H15ClF3N3O5S/c1-2-8-24(11-17(26)23-12-4-3-5-13(9-12)25(27)28)31(29,30)14-6-7-16(19)15(10-14)18(20,21)22/h2-7,9-10H,1,8,11H2,(H,23,26)