(4-tert-butyl-2,6-dimethyl-phenyl)methyl 1,2,3,4-tetrahydroacridine-9-carboxylate

Systemtic Name: (4-tert-butyl-2,6-dimethyl-phenyl)methyl 1,2,3,4-tetrahydroacridine-9-carboxylate Openeye Name: (4-tert-butyl-2,6-dimethyl-phenyl)methyl 1,2,3,4-tetrahydroacridine-9-carboxylate CAS Name: 1,2,3,4-tetrahydroacridine-9-carboxylic acid (4-tert-butyl-2,6-dimethylphenyl)methyl ester IUPAC Name: (4-tert-butyl-2,6-dimethylphenyl)methyl 1,2,3,4-tetrahydroacridine-9-carboxylate Traditional Name: 1,2,3,4-tetrahydroacridine-9-carboxylic acid (4-tert-butyl-2,6-dimethyl-benzyl) ester Formula: C27H31NO2 MolecularWeight: 401.54054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1COC(=O)C2=C3CCCCC3=NC4=CC=CC=C42)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1COC(=O)C2=C3CCCCC3=NC4=CC=CC=C42)C)C(C)(C)C

InChI

InChI=1S/C27H31NO2/c1-17-14-19(27(3,4)5)15-18(2)22(17)16-30-26(29)25-20-10-6-8-12-23(20)28-24-13-9-7-11-21(24)25/h6,8,10,12,14-15H,7,9,11,13,16H2,1-5H3