2-[(4-chlorophenyl)-(4-oxidanylidenechromen-3-yl)methyl]-1,3-diphenyl-propane-1,3-dione

Systemtic Name: 2-[(4-chlorophenyl)-(4-oxidanylidenechromen-3-yl)methyl]-1,3-diphenyl-propane-1,3-dione Openeye Name: 2-[(4-chlorophenyl)-(4-oxochromen-3-yl)methyl]-1,3-diphenyl-propane-1,3-dione CAS Name: 2-[(4-chlorophenyl)-(4-oxo-1-benzopyran-3-yl)methyl]-1,3-diphenylpropane-1,3-dione IUPAC Name: 2-[(4-chlorophenyl)-(4-oxochromen-3-yl)methyl]-1,3-diphenylpropane-1,3-dione Traditional Name: 2-[(4-chlorophenyl)-(4-ketochromen-3-yl)methyl]-1,3-diphenyl-propane-1,3-dione Formula: C31H21ClO4 MolecularWeight: 492.94904

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C(C(C2=CC=C(C=C2)Cl)C3=COC4=CC=CC=C4C3=O)C(=O)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C(C(C2=CC=C(C=C2)Cl)C3=COC4=CC=CC=C4C3=O)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C31H21ClO4/c32-23-17-15-20(16-18-23)27(25-19-36-26-14-8-7-13-24(26)31(25)35)28(29(33)21-9-3-1-4-10-21)30(34)22-11-5-2-6-12-22/h1-19,27-28H