7-(3-cyclohexyl-1,2-oxazol-5-yl)-5-methoxy-3,4-dimethyl-chromen-2-one

Systemtic Name: 7-(3-cyclohexyl-1,2-oxazol-5-yl)-5-methoxy-3,4-dimethyl-chromen-2-one Openeye Name: 7-(3-cyclohexylisoxazol-5-yl)-5-methoxy-3,4-dimethyl-chromen-2-one CAS Name: 7-(3-cyclohexyl-5-isoxazolyl)-5-methoxy-3,4-dimethyl-1-benzopyran-2-one IUPAC Name: 7-(3-cyclohexyl-1,2-oxazol-5-yl)-5-methoxy-3,4-dimethylchromen-2-one Traditional Name: 7-(3-cyclohexylisoxazol-5-yl)-5-methoxy-3,4-dimethyl-coumarin Formula: C21H23NO4 MolecularWeight: 353.41162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C(=CC(=C2)C3=CC(=NO3)C4CCCCC4)OC)C

Isomeric SMILES

CC1=C(C(=O)OC2=C1C(=CC(=C2)C3=CC(=NO3)C4CCCCC4)OC)C

InChI

InChI=1S/C21H23NO4/c1-12-13(2)21(23)25-19-10-15(9-18(24-3)20(12)19)17-11-16(22-26-17)14-7-5-4-6-8-14/h9-11,14H,4-8H2,1-3H3