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

Systemtic Name: N-[[3-ethoxy-4-[(3-fluorophenyl)methoxy]phenyl]methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-[[3-ethoxy-4-[(3-fluorophenyl)methoxy]phenyl]methyleneamino]-5-nitro-benzothiophene-2-carboxamide CAS Name: N-[[3-ethoxy-4-[(3-fluorophenyl)methoxy]phenyl]methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-[[3-ethoxy-4-[(3-fluorophenyl)methoxy]phenyl]methylideneamino]-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-[[3-ethoxy-4-(3-fluorobenzyl)oxy-benzylidene]amino]-5-nitro-benzothiophene-2-carboxamide Formula: C25H20FN3O5S MolecularWeight: 493.506803

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=NNC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])OCC4=CC(=CC=C4)F

Isomeric SMILES

CCOC1=C(C=CC(=C1)C=NNC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])OCC4=CC(=CC=C4)F

InChI

InChI=1S/C25H20FN3O5S/c1-2-33-22-11-16(6-8-21(22)34-15-17-4-3-5-19(26)10-17)14-27-28-25(30)24-13-18-12-20(29(31)32)7-9-23(18)35-24/h3-14H,2,15H2,1H3,(H,28,30)