(2E)-1-cycloheptyl-2-[7-(hydroxymethyl)-3,3,4,4-tetramethyl-2H-isoquinolin-1-ylidene]ethanone

Systemtic Name: (2E)-1-cycloheptyl-2-[7-(hydroxymethyl)-3,3,4,4-tetramethyl-2H-isoquinolin-1-ylidene]ethanone Openeye Name: (2E)-1-cycloheptyl-2-[7-(hydroxymethyl)-3,3,4,4-tetramethyl-2H-isoquinolin-1-ylidene]ethanone CAS Name: (2E)-1-cycloheptyl-2-[7-(hydroxymethyl)-3,3,4,4-tetramethyl-2H-isoquinolin-1-ylidene]ethanone IUPAC Name: (2E)-1-cycloheptyl-2-[7-(hydroxymethyl)-3,3,4,4-tetramethyl-2H-isoquinolin-1-ylidene]ethanone Traditional Name: (2E)-1-cycloheptyl-2-(3,3,4,4-tetramethyl-7-methylol-2H-isoquinolin-1-ylidene)ethanone Formula: C23H33NO2 MolecularWeight: 355.51362

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C=C(C=C2)CO)C(=CC(=O)C3CCCCCC3)NC1(C)C)C

Isomeric SMILES

CC1(C2=C(C=C(C=C2)CO)/C(=C\C(=O)C3CCCCCC3)/NC1(C)C)C

InChI

InChI=1S/C23H33NO2/c1-22(2)19-12-11-16(15-25)13-18(19)20(24-23(22,3)4)14-21(26)17-9-7-5-6-8-10-17/h11-14,17,24-25H,5-10,15H2,1-4H3/b20-14+