(3-oxidanylidene-2-phenyl-pent-4-enyl) 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-oxidanyl-phenyl]propanoate

Systemtic Name: (3-oxidanylidene-2-phenyl-pent-4-enyl) 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-oxidanyl-phenyl]propanoate Openeye Name: (3-oxo-2-phenyl-pent-4-enyl) 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxy-phenyl]propanoate CAS Name: 3-[3-(2-benzotriazolyl)-5-tert-butyl-4-hydroxyphenyl]propanoic acid (3-oxo-2-phenylpent-4-enyl) ester IUPAC Name: (3-oxo-2-phenylpent-4-enyl) 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxyphenyl]propanoate Traditional Name: 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxy-phenyl]propionic acid (3-keto-2-phenyl-pent-4-enyl) ester Formula: C30H31N3O4 MolecularWeight: 497.58484

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C(=CC(=C1)CCC(=O)OCC(C2=CC=CC=C2)C(=O)C=C)N3N=C4C=CC=CC4=N3)O

Isomeric SMILES

CC(C)(C)C1=C(C(=CC(=C1)CCC(=O)OCC(C2=CC=CC=C2)C(=O)C=C)N3N=C4C=CC=CC4=N3)O

InChI

InChI=1S/C30H31N3O4/c1-5-27(34)22(21-11-7-6-8-12-21)19-37-28(35)16-15-20-17-23(30(2,3)4)29(36)26(18-20)33-31-24-13-9-10-14-25(24)32-33/h5-14,17-18,22,36H,1,15-16,19H2,2-4H3