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

Systemtic Name: 4-[(2E)-2-[(2-bromanyl-5-ethoxy-4-propan-2-yloxy-phenyl)methylidene]hydrazinyl]benzoic acid Openeye Name: 4-[(2E)-2-[(2-bromo-5-ethoxy-4-isopropoxy-phenyl)methylene]hydrazino]benzoic acid CAS Name: 4-[(2E)-2-[(2-bromo-5-ethoxy-4-propan-2-yloxyphenyl)methylidene]hydrazinyl]benzoic acid IUPAC Name: 4-[(2E)-2-[(2-bromo-5-ethoxy-4-propan-2-yloxyphenyl)methylidene]hydrazinyl]benzoic acid Traditional Name: 4-[(N'E)-N'-(2-bromo-5-ethoxy-4-isopropoxy-benzylidene)hydrazino]benzoic acid Formula: C19H21BrN2O4 MolecularWeight: 421.28504

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21BrN2O4/c1-4-25-17-9-14(16(20)10-18(17)26-12(2)3)11-21-22-15-7-5-13(6-8-15)19(23)24/h5-12,22H,4H2,1-3H3,(H,23,24)/b21-11+