2-(4-tert-butylphenyl)-6-chloranyl-7-methyl-3-phenacyloxy-chromen-4-one

Systemtic Name: 2-(4-tert-butylphenyl)-6-chloranyl-7-methyl-3-phenacyloxy-chromen-4-one Openeye Name: 2-(4-tert-butylphenyl)-6-chloro-7-methyl-3-phenacyloxy-chromen-4-one CAS Name: 2-(4-tert-butylphenyl)-6-chloro-7-methyl-3-phenacyloxy-1-benzopyran-4-one IUPAC Name: 2-(4-tert-butylphenyl)-6-chloro-7-methyl-3-phenacyloxychromen-4-one Traditional Name: 2-(4-tert-butylphenyl)-6-chloro-7-methyl-3-phenacyloxy-chromone Formula: C28H25ClO4 MolecularWeight: 460.9487

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)OC(=C(C2=O)OCC(=O)C3=CC=CC=C3)C4=CC=C(C=C4)C(C)(C)C)Cl

Isomeric SMILES

CC1=C(C=C2C(=C1)OC(=C(C2=O)OCC(=O)C3=CC=CC=C3)C4=CC=C(C=C4)C(C)(C)C)Cl

InChI

InChI=1S/C28H25ClO4/c1-17-14-24-21(15-22(17)29)25(31)27(32-16-23(30)18-8-6-5-7-9-18)26(33-24)19-10-12-20(13-11-19)28(2,3)4/h5-15H,16H2,1-4H3