(4-tert-butylphenyl)methyl 4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate

Systemtic Name: (4-tert-butylphenyl)methyl 4-(thiophen-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate Openeye Name: (4-tert-butylphenyl)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-butylphenyl)methyl ester IUPAC Name: (4-tert-butylphenyl)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-butylbenzyl) ester Formula: C30H29NO2S MolecularWeight: 467.62176

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)COC(=O)C2=C3CCCC(=CC4=CC=CS4)C3=NC5=CC=CC=C52

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)COC(=O)C2=C3CCCC(=CC4=CC=CS4)C3=NC5=CC=CC=C52

InChI

InChI=1S/C30H29NO2S/c1-30(2,3)22-15-13-20(14-16-22)19-33-29(32)27-24-10-4-5-12-26(24)31-28-21(8-6-11-25(27)28)18-23-9-7-17-34-23/h4-5,7,9-10,12-18H,6,8,11,19H2,1-3H3