(2Z)-2-[1-(2-butoxyethoxy)-1-oxidanylidene-4-phenyl-pentan-3-ylidene]butanedioic acid

Systemtic Name: (2Z)-2-[1-(2-butoxyethoxy)-1-oxidanylidene-4-phenyl-pentan-3-ylidene]butanedioic acid Openeye Name: (2Z)-2-[3-(2-butoxyethoxy)-3-oxo-1-(1-phenylethyl)propylidene]butanedioic acid CAS Name: (2Z)-2-[1-(2-butoxyethoxy)-1-oxo-4-phenylpentan-3-ylidene]butanedioic acid IUPAC Name: (2Z)-2-[1-(2-butoxyethoxy)-1-oxo-4-phenylpentan-3-ylidene]butanedioic acid Traditional Name: (2Z)-2-[3-(2-butoxyethoxy)-3-keto-1-(1-phenylethyl)propylidene]succinic acid Formula: C21H28O7 MolecularWeight: 392.44282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCCOC(=O)CC(=C(CC(=O)O)C(=O)O)C(C)C1=CC=CC=C1

Isomeric SMILES

CCCCOCCOC(=O)C/C(=C(\CC(=O)O)/C(=O)O)/C(C)C1=CC=CC=C1

InChI

InChI=1S/C21H28O7/c1-3-4-10-27-11-12-28-20(24)14-17(18(21(25)26)13-19(22)23)15(2)16-8-6-5-7-9-16/h5-9,15H,3-4,10-14H2,1-2H3,(H,22,23)(H,25,26)/b18-17-