2,5-dimethyl-7-phenylmethoxy-3-(1-phenylpyrazol-4-yl)chromen-4-one

Systemtic Name: 2,5-dimethyl-7-phenylmethoxy-3-(1-phenylpyrazol-4-yl)chromen-4-one Openeye Name: 7-benzyloxy-2,5-dimethyl-3-(1-phenylpyrazol-4-yl)chromen-4-one CAS Name: 2,5-dimethyl-7-phenylmethoxy-3-(1-phenyl-4-pyrazolyl)-1-benzopyran-4-one IUPAC Name: 2,5-dimethyl-7-phenylmethoxy-3-(1-phenylpyrazol-4-yl)chromen-4-one Traditional Name: 7-benzoxy-2,5-dimethyl-3-(1-phenylpyrazol-4-yl)chromone Formula: C27H22N2O3 MolecularWeight: 422.47518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1C(=O)C(=C(O2)C)C3=CN(N=C3)C4=CC=CC=C4)OCC5=CC=CC=C5

Isomeric SMILES

CC1=CC(=CC2=C1C(=O)C(=C(O2)C)C3=CN(N=C3)C4=CC=CC=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C27H22N2O3/c1-18-13-23(31-17-20-9-5-3-6-10-20)14-24-25(18)27(30)26(19(2)32-24)21-15-28-29(16-21)22-11-7-4-8-12-22/h3-16H,17H2,1-2H3