5-[[3-(3,4-dichlorophenyl)-1,2-oxazol-5-yl]methoxy]-3,4-dimethyl-chromen-2-one

Systemtic Name: 5-[[3-(3,4-dichlorophenyl)-1,2-oxazol-5-yl]methoxy]-3,4-dimethyl-chromen-2-one Openeye Name: 5-[[3-(3,4-dichlorophenyl)isoxazol-5-yl]methoxy]-3,4-dimethyl-chromen-2-one CAS Name: 5-[[3-(3,4-dichlorophenyl)-5-isoxazolyl]methoxy]-3,4-dimethyl-1-benzopyran-2-one IUPAC Name: 5-[[3-(3,4-dichlorophenyl)-1,2-oxazol-5-yl]methoxy]-3,4-dimethylchromen-2-one Traditional Name: 5-[[3-(3,4-dichlorophenyl)isoxazol-5-yl]methoxy]-3,4-dimethyl-coumarin Formula: C21H15Cl2NO4 MolecularWeight: 416.2541

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C(=CC=C2)OCC3=CC(=NO3)C4=CC(=C(C=C4)Cl)Cl)C

Isomeric SMILES

CC1=C(C(=O)OC2=C1C(=CC=C2)OCC3=CC(=NO3)C4=CC(=C(C=C4)Cl)Cl)C

InChI

InChI=1S/C21H15Cl2NO4/c1-11-12(2)21(25)27-19-5-3-4-18(20(11)19)26-10-14-9-17(24-28-14)13-6-7-15(22)16(23)8-13/h3-9H,10H2,1-2H3