diethyl 2-[[2-(bromomethyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]indol-3-yl]methylidene]propanedioate

Systemtic Name: diethyl 2-[[2-(bromomethyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]indol-3-yl]methylidene]propanedioate Openeye Name: diethyl 2-[[2-(bromomethyl)-1-tert-butoxycarbonyl-indol-3-yl]methylene]propanedioate CAS Name: 2-[[2-(bromomethyl)-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-3-indolyl]methylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[2-(bromomethyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]indol-3-yl]methylidene]propanedioate Traditional Name: 2-[[2-(bromomethyl)-1-tert-butoxycarbonyl-indol-3-yl]methylene]malonic acid diethyl ester Formula: C22H26BrNO6 MolecularWeight: 480.34894

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=C(N(C2=CC=CC=C21)C(=O)OC(C)(C)C)CBr)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=CC1=C(N(C2=CC=CC=C21)C(=O)OC(C)(C)C)CBr)C(=O)OCC

InChI

InChI=1S/C22H26BrNO6/c1-6-28-19(25)16(20(26)29-7-2)12-15-14-10-8-9-11-17(14)24(18(15)13-23)21(27)30-22(3,4)5/h8-12H,6-7,13H2,1-5H3