(2E)-2-(4-butoxy-4-oxidanylidene-1-phenyl-butan-2-ylidene)butanedioic acid

Systemtic Name: (2E)-2-(4-butoxy-4-oxidanylidene-1-phenyl-butan-2-ylidene)butanedioic acid Openeye Name: (2E)-2-(1-benzyl-3-butoxy-3-oxo-propylidene)butanedioic acid CAS Name: (2E)-2-(4-butoxy-4-oxo-1-phenylbutan-2-ylidene)butanedioic acid IUPAC Name: (2E)-2-(4-butoxy-4-oxo-1-phenylbutan-2-ylidene)butanedioic acid Traditional Name: (2E)-2-(1-benzyl-3-butoxy-3-keto-propylidene)succinic acid Formula: C18H22O6 MolecularWeight: 334.36368

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CC(=C(CC(=O)O)C(=O)O)CC1=CC=CC=C1

Isomeric SMILES

CCCCOC(=O)C/C(=C(\CC(=O)O)/C(=O)O)/CC1=CC=CC=C1

InChI

InChI=1S/C18H22O6/c1-2-3-9-24-17(21)11-14(10-13-7-5-4-6-8-13)15(18(22)23)12-16(19)20/h4-8H,2-3,9-12H2,1H3,(H,19,20)(H,22,23)/b15-14+