2-[(E)-6-methylhept-1-enyl]butanedioate

Systemtic Name: 2-[(E)-6-methylhept-1-enyl]butanedioate Openeye Name: 2-[(E)-6-methylhept-1-enyl]butanedioate CAS Name: 2-[(E)-6-methylhept-1-enyl]butanedioate IUPAC Name: 2-[(E)-6-methylhept-1-enyl]butanedioate Traditional Name: 2-[(E)-6-methylhept-1-enyl]succinate Formula: C12H18O4-2 MolecularWeight: 226.26892

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC=CC(CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

CC(C)CCC/C=C/C(CC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C12H20O4/c1-9(2)6-4-3-5-7-10(12(15)16)8-11(13)14/h5,7,9-10H,3-4,6,8H2,1-2H3,(H,13,14)(H,15,16)/p-2/b7-5+