(7-methyl-2-oxidanylidene-chromen-4-yl)methyl 3-(1,3,5-trimethylpyrazol-4-yl)propanoate

Systemtic Name: (7-methyl-2-oxidanylidene-chromen-4-yl)methyl 3-(1,3,5-trimethylpyrazol-4-yl)propanoate Openeye Name: (7-methyl-2-oxo-chromen-4-yl)methyl 3-(1,3,5-trimethylpyrazol-4-yl)propanoate CAS Name: 3-(1,3,5-trimethyl-4-pyrazolyl)propanoic acid (7-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methyl-2-oxochromen-4-yl)methyl 3-(1,3,5-trimethylpyrazol-4-yl)propanoate Traditional Name: 3-(1,3,5-trimethylpyrazol-4-yl)propionic acid (2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C20H22N2O4 MolecularWeight: 354.39968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CCC3=C(N(N=C3C)C)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CCC3=C(N(N=C3C)C)C

InChI

InChI=1S/C20H22N2O4/c1-12-5-6-17-15(10-20(24)26-18(17)9-12)11-25-19(23)8-7-16-13(2)21-22(4)14(16)3/h5-6,9-10H,7-8,11H2,1-4H3