(2E)-2-[7-(aminomethyl)-3,3,6-trimethyl-2,4-dihydroisoquinolin-1-ylidene]-1-cycloheptyl-ethanone

Systemtic Name: (2E)-2-[7-(aminomethyl)-3,3,6-trimethyl-2,4-dihydroisoquinolin-1-ylidene]-1-cycloheptyl-ethanone Openeye Name: (2E)-2-[7-(aminomethyl)-3,3,6-trimethyl-2,4-dihydroisoquinolin-1-ylidene]-1-cycloheptyl-ethanone CAS Name: (2E)-2-[7-(aminomethyl)-3,3,6-trimethyl-2,4-dihydroisoquinolin-1-ylidene]-1-cycloheptylethanone IUPAC Name: (2E)-2-[7-(aminomethyl)-3,3,6-trimethyl-2,4-dihydroisoquinolin-1-ylidene]-1-cycloheptylethanone Traditional Name: (2E)-2-[7-(aminomethyl)-3,3,6-trimethyl-2,4-dihydroisoquinolin-1-ylidene]-1-cycloheptyl-ethanone Formula: C22H32N2O MolecularWeight: 340.50228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)CC(NC2=CC(=O)C3CCCCCC3)(C)C)CN

Isomeric SMILES

CC1=C(C=C\2C(=C1)CC(N/C2=C/C(=O)C3CCCCCC3)(C)C)CN

InChI

InChI=1S/C22H32N2O/c1-15-10-17-13-22(2,3)24-20(19(17)11-18(15)14-23)12-21(25)16-8-6-4-5-7-9-16/h10-12,16,24H,4-9,13-14,23H2,1-3H3/b20-12+