7-[4-(3,4-dimethylphenyl)phthalazin-1-yl]oxychromen-2-one

Systemtic Name: 7-[4-(3,4-dimethylphenyl)phthalazin-1-yl]oxychromen-2-one Openeye Name: 7-[4-(3,4-dimethylphenyl)phthalazin-1-yl]oxychromen-2-one CAS Name: 7-[[4-(3,4-dimethylphenyl)-1-phthalazinyl]oxy]-1-benzopyran-2-one IUPAC Name: 7-[4-(3,4-dimethylphenyl)phthalazin-1-yl]oxychromen-2-one Traditional Name: 7-[4-(3,4-dimethylphenyl)phthalazin-1-yl]oxycoumarin Formula: C25H18N2O3 MolecularWeight: 394.42202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)OC4=CC5=C(C=C4)C=CC(=O)O5)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)OC4=CC5=C(C=C4)C=CC(=O)O5)C

InChI

InChI=1S/C25H18N2O3/c1-15-7-8-18(13-16(15)2)24-20-5-3-4-6-21(20)25(27-26-24)29-19-11-9-17-10-12-23(28)30-22(17)14-19/h3-14H,1-2H3