(4-tert-butyl-2,6-dimethyl-phenyl)methyl 4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate

Systemtic Name: (4-tert-butyl-2,6-dimethyl-phenyl)methyl 4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate Openeye Name: (4-tert-butyl-2,6-dimethyl-phenyl)methyl 4-(2-thienylmethylene)-2,3-dihydro-1H-acridine-9-carboxylate CAS Name: 4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylic acid (4-tert-butyl-2,6-dimethylphenyl)methyl ester IUPAC Name: (4-tert-butyl-2,6-dimethylphenyl)methyl 4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate Traditional Name: 4-(2-thenylidene)-2,3-dihydro-1H-acridine-9-carboxylic acid (4-tert-butyl-2,6-dimethyl-benzyl) ester Formula: C32H33NO2S MolecularWeight: 495.67492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1COC(=O)C2=C3CCCC(=CC4=CC=CS4)C3=NC5=CC=CC=C52)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1COC(=O)C2=C3CCCC(=CC4=CC=CS4)C3=NC5=CC=CC=C52)C)C(C)(C)C

InChI

InChI=1S/C32H33NO2S/c1-20-16-23(32(3,4)5)17-21(2)27(20)19-35-31(34)29-25-12-6-7-14-28(25)33-30-22(10-8-13-26(29)30)18-24-11-9-15-36-24/h6-7,9,11-12,14-18H,8,10,13,19H2,1-5H3