(4E)-2-butyl-4-phenethylidene-1H-isoquinolin-3-one

Systemtic Name: (4E)-2-butyl-4-phenethylidene-1H-isoquinolin-3-one Openeye Name: (4E)-2-butyl-4-phenethylidene-1H-isoquinolin-3-one CAS Name: (4E)-2-butyl-4-phenethylidene-1H-isoquinolin-3-one IUPAC Name: (4E)-2-butyl-4-phenethylidene-1H-isoquinolin-3-one Traditional Name: (4E)-2-butyl-4-phenethylidene-1H-isoquinolin-3-one Formula: C21H23NO MolecularWeight: 305.41342

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CC2=CC=CC=C2C(=CCC3=CC=CC=C3)C1=O

Isomeric SMILES

CCCCN1CC2=CC=CC=C2/C(=C\CC3=CC=CC=C3)/C1=O

InChI

InChI=1S/C21H23NO/c1-2-3-15-22-16-18-11-7-8-12-19(18)20(21(22)23)14-13-17-9-5-4-6-10-17/h4-12,14H,2-3,13,15-16H2,1H3/b20-14+