diethyl 2-(6-bromanylphenanthren-9-yl)carbonylpropanedioate

Systemtic Name: diethyl 2-(6-bromanylphenanthren-9-yl)carbonylpropanedioate Openeye Name: diethyl 2-(6-bromophenanthrene-9-carbonyl)propanedioate CAS Name: 2-[(6-bromo-9-phenanthrenyl)-oxomethyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-(6-bromophenanthrene-9-carbonyl)propanedioate Traditional Name: 2-(6-bromophenanthrene-9-carbonyl)malonic acid diethyl ester Formula: C22H19BrO5 MolecularWeight: 443.28726

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)C1=CC2=CC=CC=C2C3=C1C=CC(=C3)Br)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(C(=O)C1=CC2=CC=CC=C2C3=C1C=CC(=C3)Br)C(=O)OCC

InChI

InChI=1S/C22H19BrO5/c1-3-27-21(25)19(22(26)28-4-2)20(24)18-11-13-7-5-6-8-15(13)17-12-14(23)9-10-16(17)18/h5-12,19H,3-4H2,1-2H3