2-(4-tert-butylphenyl)-6,7-dimethyl-3-[(1-methylpyrazol-4-yl)methoxy]chromen-4-one

Systemtic Name: 2-(4-tert-butylphenyl)-6,7-dimethyl-3-[(1-methylpyrazol-4-yl)methoxy]chromen-4-one Openeye Name: 2-(4-tert-butylphenyl)-6,7-dimethyl-3-[(1-methylpyrazol-4-yl)methoxy]chromen-4-one CAS Name: 2-(4-tert-butylphenyl)-6,7-dimethyl-3-[(1-methyl-4-pyrazolyl)methoxy]-1-benzopyran-4-one IUPAC Name: 2-(4-tert-butylphenyl)-6,7-dimethyl-3-[(1-methylpyrazol-4-yl)methoxy]chromen-4-one Traditional Name: 2-(4-tert-butylphenyl)-6,7-dimethyl-3-[(1-methylpyrazol-4-yl)methoxy]chromone Formula: C26H28N2O3 MolecularWeight: 416.51212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=O)C(=C(O2)C3=CC=C(C=C3)C(C)(C)C)OCC4=CN(N=C4)C)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=O)C(=C(O2)C3=CC=C(C=C3)C(C)(C)C)OCC4=CN(N=C4)C)C

InChI

InChI=1S/C26H28N2O3/c1-16-11-21-22(12-17(16)2)31-24(19-7-9-20(10-8-19)26(3,4)5)25(23(21)29)30-15-18-13-27-28(6)14-18/h7-14H,15H2,1-6H3