methyl 3-[2-[(2R)-4-(5-bromanylfuran-2-yl)carbonyl-2-methyl-piperazin-1-yl]-2-oxidanylidene-ethanoyl]-1H-indole-7-carboxylate

Systemtic Name: methyl 3-[2-[(2R)-4-(5-bromanylfuran-2-yl)carbonyl-2-methyl-piperazin-1-yl]-2-oxidanylidene-ethanoyl]-1H-indole-7-carboxylate Openeye Name: methyl 3-[2-[(2R)-4-(5-bromofuran-2-carbonyl)-2-methyl-piperazin-1-yl]-2-oxo-acetyl]-1H-indole-7-carboxylate CAS Name: 3-[2-[(2R)-4-[(5-bromo-2-furanyl)-oxomethyl]-2-methyl-1-piperazinyl]-1,2-dioxoethyl]-1H-indole-7-carboxylic acid methyl ester IUPAC Name: methyl 3-[2-[(2R)-4-(5-bromofuran-2-carbonyl)-2-methylpiperazin-1-yl]-2-oxoacetyl]-1H-indole-7-carboxylate Traditional Name: 3-[2-[(2R)-4-(5-bromo-2-furoyl)-2-methyl-piperazino]-2-keto-acetyl]-1H-indole-7-carboxylic acid methyl ester Formula: C22H20BrN3O6 MolecularWeight: 502.3147

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)C(=O)C2=CNC3=C2C=CC=C3C(=O)OC)C(=O)C4=CC=C(O4)Br

Isomeric SMILES

C[C@@H]1CN(CCN1C(=O)C(=O)C2=CNC3=C2C=CC=C3C(=O)OC)C(=O)C4=CC=C(O4)Br

InChI

InChI=1S/C22H20BrN3O6/c1-12-11-25(20(28)16-6-7-17(23)32-16)8-9-26(12)21(29)19(27)15-10-24-18-13(15)4-3-5-14(18)22(30)31-2/h3-7,10,12,24H,8-9,11H2,1-2H3/t12-/m1/s1