(2,3,4,5,6-pentamethylphenyl)methyl 4-(dimethylamino)benzoate

Systemtic Name: (2,3,4,5,6-pentamethylphenyl)methyl 4-(dimethylamino)benzoate Openeye Name: (2,3,4,5,6-pentamethylphenyl)methyl 4-(dimethylamino)benzoate CAS Name: 4-(dimethylamino)benzoic acid (2,3,4,5,6-pentamethylphenyl)methyl ester IUPAC Name: (2,3,4,5,6-pentamethylphenyl)methyl 4-(dimethylamino)benzoate Traditional Name: 4-(dimethylamino)benzoic acid (2,3,4,5,6-pentamethylbenzyl) ester Formula: C21H27NO2 MolecularWeight: 325.44458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1C)C)COC(=O)C2=CC=C(C=C2)N(C)C)C)C

Isomeric SMILES

CC1=C(C(=C(C(=C1C)C)COC(=O)C2=CC=C(C=C2)N(C)C)C)C

InChI

InChI=1S/C21H27NO2/c1-13-14(2)16(4)20(17(5)15(13)3)12-24-21(23)18-8-10-19(11-9-18)22(6)7/h8-11H,12H2,1-7H3