3-chloranyl-N-[2-chloranyl-5-[5-(hydroxymethyl)furan-2-yl]phenyl]-7-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[2-chloranyl-5-[5-(hydroxymethyl)furan-2-yl]phenyl]-7-nitro-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[2-chloro-5-[5-(hydroxymethyl)-2-furyl]phenyl]-7-nitro-benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[2-chloro-5-[5-(hydroxymethyl)-2-furanyl]phenyl]-7-nitro-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[2-chloro-5-[5-(hydroxymethyl)furan-2-yl]phenyl]-7-nitro-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[2-chloro-5-(5-methylol-2-furyl)phenyl]-7-nitro-benzothiophene-2-carboxamide Formula: C20H12Cl2N2O5S MolecularWeight: 463.29068

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)[N+](=O)[O-])SC(=C2Cl)C(=O)NC3=C(C=CC(=C3)C4=CC=C(O4)CO)Cl

Isomeric SMILES

C1=CC2=C(C(=C1)[N+](=O)[O-])SC(=C2Cl)C(=O)NC3=C(C=CC(=C3)C4=CC=C(O4)CO)Cl

InChI

InChI=1S/C20H12Cl2N2O5S/c21-13-6-4-10(16-7-5-11(9-25)29-16)8-14(13)23-20(26)19-17(22)12-2-1-3-15(24(27)28)18(12)30-19/h1-8,25H,9H2,(H,23,26)