3-[2-(phenylmethyl)isoquinolin-1-ylidene]pentane-2,4-dione

Systemtic Name: 3-[2-(phenylmethyl)isoquinolin-1-ylidene]pentane-2,4-dione Openeye Name: 3-(2-benzyl-1-isoquinolylidene)pentane-2,4-dione CAS Name: 3-[2-(phenylmethyl)-1-isoquinolinylidene]pentane-2,4-dione IUPAC Name: 3-(2-benzylisoquinolin-1-ylidene)pentane-2,4-dione Traditional Name: 3-(2-benzyl-1-isoquinolylidene)pentane-2,4-dione Formula: C21H19NO2 MolecularWeight: 317.38106

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=C1C2=CC=CC=C2C=CN1CC3=CC=CC=C3)C(=O)C

Isomeric SMILES

CC(=O)C(=C1C2=CC=CC=C2C=CN1CC3=CC=CC=C3)C(=O)C

InChI

InChI=1S/C21H19NO2/c1-15(23)20(16(2)24)21-19-11-7-6-10-18(19)12-13-22(21)14-17-8-4-3-5-9-17/h3-13H,14H2,1-2H3