diethyl 2-[(2-bromophenyl)methyl]-2-prop-2-ynyl-propanedioate

Systemtic Name: diethyl 2-[(2-bromophenyl)methyl]-2-prop-2-ynyl-propanedioate Openeye Name: diethyl 2-[(2-bromophenyl)methyl]-2-prop-2-ynyl-propanedioate CAS Name: 2-[(2-bromophenyl)methyl]-2-prop-2-ynylpropanedioic acid diethyl ester IUPAC Name: diethyl 2-[(2-bromophenyl)methyl]-2-prop-2-ynylpropanedioate Traditional Name: 2-(2-bromobenzyl)-2-propargyl-malonic acid diethyl ester Formula: C17H19BrO4 MolecularWeight: 367.23436

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC#C)(CC1=CC=CC=C1Br)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(CC#C)(CC1=CC=CC=C1Br)C(=O)OCC

InChI

InChI=1S/C17H19BrO4/c1-4-11-17(15(19)21-5-2,16(20)22-6-3)12-13-9-7-8-10-14(13)18/h1,7-10H,5-6,11-12H2,2-3H3