(2E)-2-(7-ethyl-3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-1-phenyl-ethanone

Systemtic Name: (2E)-2-(7-ethyl-3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-1-phenyl-ethanone Openeye Name: (2E)-2-(7-ethyl-3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-1-phenyl-ethanone CAS Name: (2E)-2-(7-ethyl-3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-1-phenylethanone IUPAC Name: (2E)-2-(7-ethyl-3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-1-phenylethanone Traditional Name: (2E)-2-(7-ethyl-3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-1-phenyl-ethanone Formula: C21H23NO MolecularWeight: 305.41342

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(CC(NC2=CC(=O)C3=CC=CC=C3)(C)C)C=C1

Isomeric SMILES

CCC1=CC\2=C(CC(N/C2=C/C(=O)C3=CC=CC=C3)(C)C)C=C1

InChI

InChI=1S/C21H23NO/c1-4-15-10-11-17-14-21(2,3)22-19(18(17)12-15)13-20(23)16-8-6-5-7-9-16/h5-13,22H,4,14H2,1-3H3/b19-13+