[4-(3-bromanylpropyl)-2-oxidanyl-phenyl] 2-[(4-phenethyloxyphenyl)methylideneamino]ethanoate

Systemtic Name: [4-(3-bromanylpropyl)-2-oxidanyl-phenyl] 2-[(4-phenethyloxyphenyl)methylideneamino]ethanoate Openeye Name: [4-(3-bromopropyl)-2-hydroxy-phenyl] 2-[(4-phenethyloxyphenyl)methyleneamino]acetate CAS Name: 2-[(4-phenethyloxyphenyl)methylideneamino]acetic acid [4-(3-bromopropyl)-2-hydroxyphenyl] ester IUPAC Name: [4-(3-bromopropyl)-2-hydroxyphenyl] 2-[(4-phenethyloxyphenyl)methylideneamino]acetate Traditional Name: 2-[(4-phenethyloxybenzylidene)amino]acetic acid [4-(3-bromopropyl)-2-hydroxy-phenyl] ester Formula: C26H26BrNO4 MolecularWeight: 496.39294

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCOC2=CC=C(C=C2)C=NCC(=O)OC3=C(C=C(C=C3)CCCBr)O

Isomeric SMILES

C1=CC=C(C=C1)CCOC2=CC=C(C=C2)C=NCC(=O)OC3=C(C=C(C=C3)CCCBr)O

InChI

InChI=1S/C26H26BrNO4/c27-15-4-7-21-10-13-25(24(29)17-21)32-26(30)19-28-18-22-8-11-23(12-9-22)31-16-14-20-5-2-1-3-6-20/h1-3,5-6,8-13,17-18,29H,4,7,14-16,19H2