(3-cyanophenyl)methyl (2S)-2-tert-butyl-1,2,3,4-tetrahydroacridine-9-carboxylate

Systemtic Name: (3-cyanophenyl)methyl (2S)-2-tert-butyl-1,2,3,4-tetrahydroacridine-9-carboxylate Openeye Name: (3-cyanophenyl)methyl (2S)-2-tert-butyl-1,2,3,4-tetrahydroacridine-9-carboxylate CAS Name: (2S)-2-tert-butyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid (3-cyanophenyl)methyl ester IUPAC Name: (3-cyanophenyl)methyl (2S)-2-tert-butyl-1,2,3,4-tetrahydroacridine-9-carboxylate Traditional Name: (2S)-2-tert-butyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid (3-cyanobenzyl) ester Formula: C26H26N2O2 MolecularWeight: 398.49684

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=NC3=CC=CC=C3C(=C2C1)C(=O)OCC4=CC=CC(=C4)C#N

Isomeric SMILES

CC(C)(C)[C@H]1CCC2=NC3=CC=CC=C3C(=C2C1)C(=O)OCC4=CC=CC(=C4)C#N

InChI

InChI=1S/C26H26N2O2/c1-26(2,3)19-11-12-23-21(14-19)24(20-9-4-5-10-22(20)28-23)25(29)30-16-18-8-6-7-17(13-18)15-27/h4-10,13,19H,11-12,14,16H2,1-3H3/t19-/m0/s1