2-tert-butyl-4-[(2-phenylmethoxyphenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylic acid

Systemtic Name: 2-tert-butyl-4-[(2-phenylmethoxyphenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylic acid Openeye Name: 4-[(2-benzyloxyphenyl)methylene]-2-tert-butyl-2,3-dihydro-1H-acridine-9-carboxylic acid CAS Name: 2-tert-butyl-4-[(2-phenylmethoxyphenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylic acid IUPAC Name: 2-tert-butyl-4-[(2-phenylmethoxyphenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylic acid Traditional Name: 4-(2-benzoxybenzylidene)-2-tert-butyl-2,3-dihydro-1H-acridine-9-carboxylic acid Formula: C32H31NO3 MolecularWeight: 477.59344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CC(=CC2=CC=CC=C2OCC3=CC=CC=C3)C4=NC5=CC=CC=C5C(=C4C1)C(=O)O

Isomeric SMILES

CC(C)(C)C1CC(=CC2=CC=CC=C2OCC3=CC=CC=C3)C4=NC5=CC=CC=C5C(=C4C1)C(=O)O

InChI

InChI=1S/C32H31NO3/c1-32(2,3)24-18-23(17-22-13-7-10-16-28(22)36-20-21-11-5-4-6-12-21)30-26(19-24)29(31(34)35)25-14-8-9-15-27(25)33-30/h4-17,24H,18-20H2,1-3H3,(H,34,35)