5-nitro-N-[(4-phenylmethoxyphenyl)methylideneamino]-1-benzothiophene-2-carboxamide

Systemtic Name: 5-nitro-N-[(4-phenylmethoxyphenyl)methylideneamino]-1-benzothiophene-2-carboxamide Openeye Name: N-[(4-benzyloxyphenyl)methyleneamino]-5-nitro-benzothiophene-2-carboxamide CAS Name: 5-nitro-N-[(4-phenylmethoxyphenyl)methylideneamino]-1-benzothiophene-2-carboxamide IUPAC Name: 5-nitro-N-[(4-phenylmethoxyphenyl)methylideneamino]-1-benzothiophene-2-carboxamide Traditional Name: N-[(4-benzoxybenzylidene)amino]-5-nitro-benzothiophene-2-carboxamide Formula: C23H17N3O4S MolecularWeight: 431.46378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H17N3O4S/c27-23(22-13-18-12-19(26(28)29)8-11-21(18)31-22)25-24-14-16-6-9-20(10-7-16)30-15-17-4-2-1-3-5-17/h1-14H,15H2,(H,25,27)