6-chloranyl-3,4-dimethyl-7-[2-oxidanylidene-2-(4-phenylphenyl)ethoxy]chromen-2-one

Systemtic Name: 6-chloranyl-3,4-dimethyl-7-[2-oxidanylidene-2-(4-phenylphenyl)ethoxy]chromen-2-one Openeye Name: 6-chloro-3,4-dimethyl-7-[2-oxo-2-(4-phenylphenyl)ethoxy]chromen-2-one CAS Name: 6-chloro-3,4-dimethyl-7-[2-oxo-2-(4-phenylphenyl)ethoxy]-1-benzopyran-2-one IUPAC Name: 6-chloro-3,4-dimethyl-7-[2-oxo-2-(4-phenylphenyl)ethoxy]chromen-2-one Traditional Name: 6-chloro-7-[2-keto-2-(4-phenylphenyl)ethoxy]-3,4-dimethyl-coumarin Formula: C25H19ClO4 MolecularWeight: 418.86896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)OCC(=O)C3=CC=C(C=C3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)OCC(=O)C3=CC=C(C=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C25H19ClO4/c1-15-16(2)25(28)30-23-13-24(21(26)12-20(15)23)29-14-22(27)19-10-8-18(9-11-19)17-6-4-3-5-7-17/h3-13H,14H2,1-2H3