N-[3,5-bis(trifluoromethyl)phenyl]-3-chloranyl-7-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[3,5-bis(trifluoromethyl)phenyl]-3-chloranyl-7-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-[3,5-bis(trifluoromethyl)phenyl]-3-chloro-7-nitro-benzothiophene-2-carboxamide CAS Name: N-[3,5-bis(trifluoromethyl)phenyl]-3-chloro-7-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-[3,5-bis(trifluoromethyl)phenyl]-3-chloro-7-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-[3,5-bis(trifluoromethyl)phenyl]-3-chloro-7-nitro-benzothiophene-2-carboxamide Formula: C17H7ClF6N2O3S MolecularWeight: 468.757499

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)[N+](=O)[O-])SC(=C2Cl)C(=O)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1=CC2=C(C(=C1)[N+](=O)[O-])SC(=C2Cl)C(=O)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C17H7ClF6N2O3S/c18-12-10-2-1-3-11(26(28)29)13(10)30-14(12)15(27)25-9-5-7(16(19,20)21)4-8(6-9)17(22,23)24/h1-6H,(H,25,27)