(2R,4E)-2-tert-butyl-4-[(3-hydroxyphenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate

Systemtic Name: (2R,4E)-2-tert-butyl-4-[(3-hydroxyphenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate Openeye Name: (2R,4E)-2-tert-butyl-4-[(3-hydroxyphenyl)methylene]-2,3-dihydro-1H-acridine-9-carboxylate CAS Name: (2R,4E)-2-tert-butyl-4-[(3-hydroxyphenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate IUPAC Name: (2R,4E)-2-tert-butyl-4-[(3-hydroxyphenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate Traditional Name: (2R,4E)-2-tert-butyl-4-(3-hydroxybenzylidene)-2,3-dihydro-1H-acridine-9-carboxylate Formula: C25H24NO3- MolecularWeight: 386.46296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CC(=CC2=CC(=CC=C2)O)C3=NC4=CC=CC=C4C(=C3C1)C(=O)[O-]

Isomeric SMILES

CC(C)(C)[C@@H]1C/C(=C\C2=CC(=CC=C2)O)/C3=NC4=CC=CC=C4C(=C3C1)C(=O)[O-]

InChI

InChI=1S/C25H25NO3/c1-25(2,3)17-13-16(11-15-7-6-8-18(27)12-15)23-20(14-17)22(24(28)29)19-9-4-5-10-21(19)26-23/h4-12,17,27H,13-14H2,1-3H3,(H,28,29)/p-1/b16-11+/t17-/m1/s1