(E)-3-(4-chlorophenyl)-1-(5-methyl-1-benzofuran-2-yl)prop-2-en-1-one; methanoic acid

Systemtic Name: (E)-3-(4-chlorophenyl)-1-(5-methyl-1-benzofuran-2-yl)prop-2-en-1-one; methanoic acid Openeye Name: (E)-3-(4-chlorophenyl)-1-(5-methylbenzofuran-2-yl)prop-2-en-1-one; formic acid CAS Name: (E)-3-(4-chlorophenyl)-1-(5-methyl-2-benzofuranyl)-2-propen-1-one; formic acid IUPAC Name: (E)-3-(4-chlorophenyl)-1-(5-methyl-1-benzofuran-2-yl)prop-2-en-1-one; formic acid Traditional Name: (E)-3-(4-chlorophenyl)-1-(5-methylbenzofuran-2-yl)prop-2-en-1-one; formic acid Formula: C19H15ClO4 MolecularWeight: 342.773

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(=C2)C(=O)C=CC3=CC=C(C=C3)Cl.C(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1)OC(=C2)C(=O)/C=C/C3=CC=C(C=C3)Cl.C(=O)O

InChI

InChI=1S/C18H13ClO2.CH2O2/c1-12-2-9-17-14(10-12)11-18(21-17)16(20)8-5-13-3-6-15(19)7-4-13;2-1-3/h2-11H,1H3;1H,(H,2,3)/b8-5+;