5-nitro-N-[(3-nitro-4-phenylmethoxy-phenyl)methylideneamino]-1-benzothiophene-2-carboxamide

Systemtic Name: 5-nitro-N-[(3-nitro-4-phenylmethoxy-phenyl)methylideneamino]-1-benzothiophene-2-carboxamide Openeye Name: N-[(4-benzyloxy-3-nitro-phenyl)methyleneamino]-5-nitro-benzothiophene-2-carboxamide CAS Name: 5-nitro-N-[(3-nitro-4-phenylmethoxyphenyl)methylideneamino]-1-benzothiophene-2-carboxamide IUPAC Name: 5-nitro-N-[(3-nitro-4-phenylmethoxyphenyl)methylideneamino]-1-benzothiophene-2-carboxamide Traditional Name: N-[(4-benzoxy-3-nitro-benzylidene)amino]-5-nitro-benzothiophene-2-carboxamide Formula: C23H16N4O6S MolecularWeight: 476.46134

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)C=NNC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)C=NNC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C23H16N4O6S/c28-23(22-12-17-11-18(26(29)30)7-9-21(17)34-22)25-24-13-16-6-8-20(19(10-16)27(31)32)33-14-15-4-2-1-3-5-15/h1-13H,14H2,(H,25,28)