3-chloranyl-N-[(E)-(2-chloranyl-5-nitro-phenyl)methylideneamino]-6-methoxy-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[(E)-(2-chloranyl-5-nitro-phenyl)methylideneamino]-6-methoxy-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[(E)-(2-chloro-5-nitro-phenyl)methyleneamino]-6-methoxy-benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[(E)-(2-chloro-5-nitrophenyl)methylideneamino]-6-methoxy-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[(E)-(2-chloro-5-nitrophenyl)methylideneamino]-6-methoxy-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[(E)-(2-chloro-5-nitro-benzylidene)amino]-6-methoxy-benzothiophene-2-carboxamide Formula: C17H11Cl2N3O4S MolecularWeight: 424.25794

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=C(S2)C(=O)NN=CC3=C(C=CC(=C3)[N+](=O)[O-])Cl)Cl

Isomeric SMILES

COC1=CC2=C(C=C1)C(=C(S2)C(=O)N/N=C/C3=C(C=CC(=C3)[N+](=O)[O-])Cl)Cl

InChI

InChI=1S/C17H11Cl2N3O4S/c1-26-11-3-4-12-14(7-11)27-16(15(12)19)17(23)21-20-8-9-6-10(22(24)25)2-5-13(9)18/h2-8H,1H3,(H,21,23)/b20-8+