[4-[7-(4-bromophenyl)carbonyloxy-2-methyl-5-oxidanyl-4-oxidanylidene-chromen-8-yl]-1-methyl-piperidin-3-yl] 4-bromanylbenzoate

Systemtic Name: [4-[7-(4-bromophenyl)carbonyloxy-2-methyl-5-oxidanyl-4-oxidanylidene-chromen-8-yl]-1-methyl-piperidin-3-yl] 4-bromanylbenzoate Openeye Name: [4-[7-(4-bromobenzoyl)oxy-5-hydroxy-2-methyl-4-oxo-chromen-8-yl]-1-methyl-3-piperidyl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [4-[7-[(4-bromophenyl)-oxomethoxy]-5-hydroxy-2-methyl-4-oxo-1-benzopyran-8-yl]-1-methyl-3-piperidinyl] ester IUPAC Name: [4-[7-(4-bromobenzoyl)oxy-5-hydroxy-2-methyl-4-oxochromen-8-yl]-1-methylpiperidin-3-yl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [4-[7-(4-bromobenzoyl)oxy-5-hydroxy-4-keto-2-methyl-chromen-8-yl]-1-methyl-3-piperidyl] ester Formula: C30H25Br2NO7 MolecularWeight: 671.33

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C2=C(O1)C(=C(C=C2O)OC(=O)C3=CC=C(C=C3)Br)C4CCN(CC4OC(=O)C5=CC=C(C=C5)Br)C

Isomeric SMILES

CC1=CC(=O)C2=C(O1)C(=C(C=C2O)OC(=O)C3=CC=C(C=C3)Br)C4CCN(CC4OC(=O)C5=CC=C(C=C5)Br)C

InChI

InChI=1S/C30H25Br2NO7/c1-16-13-22(34)27-23(35)14-24(39-29(36)17-3-7-19(31)8-4-17)26(28(27)38-16)21-11-12-33(2)15-25(21)40-30(37)18-5-9-20(32)10-6-18/h3-10,13-14,21,25,35H,11-12,15H2,1-2H3