(2E)-2-[5-butoxy-1-(4-methylphenoxy)-1-oxidanylidene-pentan-3-ylidene]butanedioic acid

Systemtic Name: (2E)-2-[5-butoxy-1-(4-methylphenoxy)-1-oxidanylidene-pentan-3-ylidene]butanedioic acid Openeye Name: (2E)-2-[1-(2-butoxyethyl)-3-(4-methylphenoxy)-3-oxo-propylidene]butanedioic acid CAS Name: (2E)-2-[5-butoxy-1-(4-methylphenoxy)-1-oxopentan-3-ylidene]butanedioic acid IUPAC Name: (2E)-2-[5-butoxy-1-(4-methylphenoxy)-1-oxopentan-3-ylidene]butanedioic acid Traditional Name: (2E)-2-[1-(2-butoxyethyl)-3-keto-3-(4-methylphenoxy)propylidene]succinic acid Formula: C20H26O7 MolecularWeight: 378.41624

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCCC(=C(CC(=O)O)C(=O)O)CC(=O)OC1=CC=C(C=C1)C

Isomeric SMILES

CCCCOCC/C(=C(/CC(=O)O)\C(=O)O)/CC(=O)OC1=CC=C(C=C1)C

InChI

InChI=1S/C20H26O7/c1-3-4-10-26-11-9-15(17(20(24)25)13-18(21)22)12-19(23)27-16-7-5-14(2)6-8-16/h5-8H,3-4,9-13H2,1-2H3,(H,21,22)(H,24,25)/b17-15+