(2E)-2-(5-butoxy-1-hexoxy-1-oxidanylidene-pentan-3-ylidene)butanedioic acid

Systemtic Name: (2E)-2-(5-butoxy-1-hexoxy-1-oxidanylidene-pentan-3-ylidene)butanedioic acid Openeye Name: (2E)-2-[1-(2-butoxyethyl)-3-hexoxy-3-oxo-propylidene]butanedioic acid CAS Name: (2E)-2-(5-butoxy-1-hexoxy-1-oxopentan-3-ylidene)butanedioic acid IUPAC Name: (2E)-2-(5-butoxy-1-hexoxy-1-oxopentan-3-ylidene)butanedioic acid Traditional Name: (2E)-2-[1-(2-butoxyethyl)-3-hexoxy-3-keto-propylidene]succinic acid Formula: C19H32O7 MolecularWeight: 372.45318

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)CC(=C(CC(=O)O)C(=O)O)CCOCCCC

Isomeric SMILES

CCCCCCOC(=O)C/C(=C(\CC(=O)O)/C(=O)O)/CCOCCCC

InChI

InChI=1S/C19H32O7/c1-3-5-7-8-11-26-18(22)13-15(9-12-25-10-6-4-2)16(19(23)24)14-17(20)21/h3-14H2,1-2H3,(H,20,21)(H,23,24)/b16-15+