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

Systemtic Name: 3-chloranyl-N-[3-(5-chloranyl-1,3-benzoxazol-2-yl)phenyl]-7-nitro-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[3-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-7-nitro-benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[3-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-7-nitro-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[3-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-7-nitro-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[3-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-7-nitro-benzothiophene-2-carboxamide Formula: C22H11Cl2N3O4S MolecularWeight: 484.31144

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)C2=C(C3=C(S2)C(=CC=C3)[N+](=O)[O-])Cl)C4=NC5=C(O4)C=CC(=C5)Cl

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)C2=C(C3=C(S2)C(=CC=C3)[N+](=O)[O-])Cl)C4=NC5=C(O4)C=CC(=C5)Cl

InChI

InChI=1S/C22H11Cl2N3O4S/c23-12-7-8-17-15(10-12)26-22(31-17)11-3-1-4-13(9-11)25-21(28)20-18(24)14-5-2-6-16(27(29)30)19(14)32-20/h1-10H,(H,25,28)