(7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl 2-[(5-bromanylfuran-2-yl)carbonylamino]ethanoate

Systemtic Name: (7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl 2-[(5-bromanylfuran-2-yl)carbonylamino]ethanoate Openeye Name: (6-isopropyl-7-methyl-2-oxo-chromen-4-yl)methyl 2-[(5-bromofuran-2-carbonyl)amino]acetate CAS Name: 2-[[(5-bromo-2-furanyl)-oxomethyl]amino]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-[(5-bromofuran-2-carbonyl)amino]acetate Traditional Name: 2-[(5-bromo-2-furoyl)amino]acetic acid (6-isopropyl-2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C21H20BrNO6 MolecularWeight: 462.2906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)CNC(=O)C3=CC=C(O3)Br)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)CNC(=O)C3=CC=C(O3)Br)C(C)C

InChI

InChI=1S/C21H20BrNO6/c1-11(2)14-8-15-13(7-19(24)29-17(15)6-12(14)3)10-27-20(25)9-23-21(26)16-4-5-18(22)28-16/h4-8,11H,9-10H2,1-3H3,(H,23,26)