methyl 4-[(E)-2-(1,1,3,3-tetramethyl-2H-isoindol-5-yl)ethenyl]benzoate

Systemtic Name: methyl 4-[(E)-2-(1,1,3,3-tetramethyl-2H-isoindol-5-yl)ethenyl]benzoate Openeye Name: methyl 4-[(E)-2-(1,1,3,3-tetramethylisoindolin-5-yl)vinyl]benzoate CAS Name: 4-[(E)-2-(1,1,3,3-tetramethyl-2H-isoindol-5-yl)ethenyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-2-(1,1,3,3-tetramethyl-2H-isoindol-5-yl)ethenyl]benzoate Traditional Name: 4-[(E)-2-(1,1,3,3-tetramethylisoindolin-5-yl)vinyl]benzoic acid methyl ester Formula: C22H25NO2 MolecularWeight: 335.4394

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C=C(C=C2)C=CC3=CC=C(C=C3)C(=O)OC)C(N1)(C)C)C

Isomeric SMILES

CC1(C2=C(C=C(C=C2)/C=C/C3=CC=C(C=C3)C(=O)OC)C(N1)(C)C)C

InChI

InChI=1S/C22H25NO2/c1-21(2)18-13-10-16(14-19(18)22(3,4)23-21)7-6-15-8-11-17(12-9-15)20(24)25-5/h6-14,23H,1-5H3/b7-6+