3-[1-(4-chlorophenyl)-3-ethanoyl-pyrazol-4-yl]carbonylchromen-2-one

Systemtic Name: 3-[1-(4-chlorophenyl)-3-ethanoyl-pyrazol-4-yl]carbonylchromen-2-one Openeye Name: 3-[3-acetyl-1-(4-chlorophenyl)pyrazole-4-carbonyl]chromen-2-one CAS Name: 3-[[3-acetyl-1-(4-chlorophenyl)-4-pyrazolyl]-oxomethyl]-1-benzopyran-2-one IUPAC Name: 3-[3-acetyl-1-(4-chlorophenyl)pyrazole-4-carbonyl]chromen-2-one Traditional Name: 3-[3-acetyl-1-(4-chlorophenyl)pyrazole-4-carbonyl]coumarin Formula: C21H13ClN2O4 MolecularWeight: 392.79192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=NN(C=C1C(=O)C2=CC3=CC=CC=C3OC2=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC(=O)C1=NN(C=C1C(=O)C2=CC3=CC=CC=C3OC2=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H13ClN2O4/c1-12(25)19-17(11-24(23-19)15-8-6-14(22)7-9-15)20(26)16-10-13-4-2-3-5-18(13)28-21(16)27/h2-11H,1H3