[5-bromanyl-3-cyclopropyl-7-methyl-6,8-bis(oxidanylidene)isochromen-7-yl] furan-2-carboxylate

Systemtic Name: [5-bromanyl-3-cyclopropyl-7-methyl-6,8-bis(oxidanylidene)isochromen-7-yl] furan-2-carboxylate Openeye Name: (5-bromo-3-cyclopropyl-7-methyl-6,8-dioxo-isochromen-7-yl) furan-2-carboxylate CAS Name: 2-furancarboxylic acid (5-bromo-3-cyclopropyl-7-methyl-6,8-dioxo-2-benzopyran-7-yl) ester IUPAC Name: (5-bromo-3-cyclopropyl-7-methyl-6,8-dioxoisochromen-7-yl) furan-2-carboxylate Traditional Name: furan-2-carboxylic acid (5-bromo-3-cyclopropyl-6,8-diketo-7-methyl-isochromen-7-yl) ester Formula: C18H13BrO6 MolecularWeight: 405.19622

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)C2=COC(=CC2=C(C1=O)Br)C3CC3)OC(=O)C4=CC=CO4

Isomeric SMILES

CC1(C(=O)C2=COC(=CC2=C(C1=O)Br)C3CC3)OC(=O)C4=CC=CO4

InChI

InChI=1S/C18H13BrO6/c1-18(25-17(22)12-3-2-6-23-12)15(20)11-8-24-13(9-4-5-9)7-10(11)14(19)16(18)21/h2-3,6-9H,4-5H2,1H3