(7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl 2-(4-bromophenyl)ethanoate

Systemtic Name: (7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl 2-(4-bromophenyl)ethanoate Openeye Name: (6-isopropyl-7-methyl-2-oxo-chromen-4-yl)methyl 2-(4-bromophenyl)acetate CAS Name: 2-(4-bromophenyl)acetic acid (7-methyl-2-oxo-6-propan-2-yl-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methyl-2-oxo-6-propan-2-ylchromen-4-yl)methyl 2-(4-bromophenyl)acetate Traditional Name: 2-(4-bromophenyl)acetic acid (6-isopropyl-2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C22H21BrO4 MolecularWeight: 429.30374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)CC3=CC=C(C=C3)Br)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)CC3=CC=C(C=C3)Br)C(C)C

InChI

InChI=1S/C22H21BrO4/c1-13(2)18-11-19-16(10-22(25)27-20(19)8-14(18)3)12-26-21(24)9-15-4-6-17(23)7-5-15/h4-8,10-11,13H,9,12H2,1-3H3