(2S)-2-hexyl-3-methylidene-butanedioic acid

Systemtic Name: (2S)-2-hexyl-3-methylidene-butanedioic acid Openeye Name: (2S)-2-hexyl-3-methylene-butanedioic acid CAS Name: (2S)-2-hexyl-3-methylenebutanedioic acid IUPAC Name: (2S)-2-hexyl-3-methylidenebutanedioic acid Traditional Name: (2S)-2-hexyl-3-methylene-succinic acid Formula: C11H18O4 MolecularWeight: 214.25822

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(=C)C(=O)O)C(=O)O

Isomeric SMILES

CCCCCC[C@@H](C(=C)C(=O)O)C(=O)O

InChI

InChI=1S/C11H18O4/c1-3-4-5-6-7-9(11(14)15)8(2)10(12)13/h9H,2-7H2,1H3,(H,12,13)(H,14,15)/t9-/m0/s1