N-[[5-[2-(2-chloranyl-4-nitro-phenoxy)ethanoyl]thiophen-2-yl]methyl]-2,2-dimethyl-propanamide

Systemtic Name: N-[[5-[2-(2-chloranyl-4-nitro-phenoxy)ethanoyl]thiophen-2-yl]methyl]-2,2-dimethyl-propanamide Openeye Name: N-[[5-[2-(2-chloro-4-nitro-phenoxy)acetyl]-2-thienyl]methyl]-2,2-dimethyl-propanamide CAS Name: N-[[5-[2-(2-chloro-4-nitrophenoxy)-1-oxoethyl]-2-thiophenyl]methyl]-2,2-dimethylpropanamide IUPAC Name: N-[[5-[2-(2-chloro-4-nitrophenoxy)acetyl]thiophen-2-yl]methyl]-2,2-dimethylpropanamide Traditional Name: N-[[5-[2-(2-chloro-4-nitro-phenoxy)acetyl]-2-thienyl]methyl]-2,2-dimethyl-propionamide Formula: C18H19ClN2O5S MolecularWeight: 410.87186

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NCC1=CC=C(S1)C(=O)COC2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)(C)C(=O)NCC1=CC=C(S1)C(=O)COC2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H19ClN2O5S/c1-18(2,3)17(23)20-9-12-5-7-16(27-12)14(22)10-26-15-6-4-11(21(24)25)8-13(15)19/h4-8H,9-10H2,1-3H3,(H,20,23)