3-[(2E)-2-[(4-acetyloxy-2-bromanyl-5-ethoxy-phenyl)methylidene]hydrazinyl]benzoic acid

Systemtic Name: 3-[(2E)-2-[(4-acetyloxy-2-bromanyl-5-ethoxy-phenyl)methylidene]hydrazinyl]benzoic acid Openeye Name: 3-[(2E)-2-[(4-acetoxy-2-bromo-5-ethoxy-phenyl)methylene]hydrazino]benzoic acid CAS Name: 3-[(2E)-2-[(4-acetyloxy-2-bromo-5-ethoxyphenyl)methylidene]hydrazinyl]benzoic acid IUPAC Name: 3-[(2E)-2-[(4-acetyloxy-2-bromo-5-ethoxyphenyl)methylidene]hydrazinyl]benzoic acid Traditional Name: 3-[(N'E)-N'-(4-acetoxy-2-bromo-5-ethoxy-benzylidene)hydrazino]benzoic acid Formula: C18H17BrN2O5 MolecularWeight: 421.24198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C=NNC2=CC=CC(=C2)C(=O)O)Br)OC(=O)C

Isomeric SMILES

CCOC1=C(C=C(C(=C1)/C=N/NC2=CC=CC(=C2)C(=O)O)Br)OC(=O)C

InChI

InChI=1S/C18H17BrN2O5/c1-3-25-16-8-13(15(19)9-17(16)26-11(2)22)10-20-21-14-6-4-5-12(7-14)18(23)24/h4-10,21H,3H2,1-2H3,(H,23,24)/b20-10+