(2E)-1-cycloheptyl-2-(3,3,6-trimethyl-2,4-dihydroisoquinolin-1-ylidene)ethanone

Systemtic Name: (2E)-1-cycloheptyl-2-(3,3,6-trimethyl-2,4-dihydroisoquinolin-1-ylidene)ethanone Openeye Name: (2E)-1-cycloheptyl-2-(3,3,6-trimethyl-2,4-dihydroisoquinolin-1-ylidene)ethanone CAS Name: (2E)-1-cycloheptyl-2-(3,3,6-trimethyl-2,4-dihydroisoquinolin-1-ylidene)ethanone IUPAC Name: (2E)-1-cycloheptyl-2-(3,3,6-trimethyl-2,4-dihydroisoquinolin-1-ylidene)ethanone Traditional Name: (2E)-1-cycloheptyl-2-(3,3,6-trimethyl-2,4-dihydroisoquinolin-1-ylidene)ethanone Formula: C21H29NO MolecularWeight: 311.46106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=O)C3CCCCCC3)NC(C2)(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)/C(=C\C(=O)C3CCCCCC3)/NC(C2)(C)C

InChI

InChI=1S/C21H29NO/c1-15-10-11-18-17(12-15)14-21(2,3)22-19(18)13-20(23)16-8-6-4-5-7-9-16/h10-13,16,22H,4-9,14H2,1-3H3/b19-13+