4-[(3-methoxy-4-oxidanyl-phenyl)-(2-oxidanyl-4-oxidanylidene-chromen-3-yl)methyl]-1,5-dimethyl-2-phenyl-pyrazol-3-one

Systemtic Name: 4-[(3-methoxy-4-oxidanyl-phenyl)-(2-oxidanyl-4-oxidanylidene-chromen-3-yl)methyl]-1,5-dimethyl-2-phenyl-pyrazol-3-one Openeye Name: 4-[(4-hydroxy-3-methoxy-phenyl)-(2-hydroxy-4-oxo-chromen-3-yl)methyl]-1,5-dimethyl-2-phenyl-pyrazol-3-one CAS Name: 4-[(4-hydroxy-3-methoxyphenyl)-(2-hydroxy-4-oxo-1-benzopyran-3-yl)methyl]-1,5-dimethyl-2-phenyl-3-pyrazolone IUPAC Name: 4-[(4-hydroxy-3-methoxyphenyl)-(2-hydroxy-4-oxochromen-3-yl)methyl]-1,5-dimethyl-2-phenylpyrazol-3-one Traditional Name: 4-[(2-hydroxy-4-keto-chromen-3-yl)-(4-hydroxy-3-methoxy-phenyl)methyl]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C28H24N2O6 MolecularWeight: 484.49996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)C(C3=CC(=C(C=C3)O)OC)C4=C(OC5=CC=CC=C5C4=O)O

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)C(C3=CC(=C(C=C3)O)OC)C4=C(OC5=CC=CC=C5C4=O)O

InChI

InChI=1S/C28H24N2O6/c1-16-23(27(33)30(29(16)2)18-9-5-4-6-10-18)24(17-13-14-20(31)22(15-17)35-3)25-26(32)19-11-7-8-12-21(19)36-28(25)34/h4-15,24,31,34H,1-3H3