[(3S,4S)-3-methylnon-1-en-4-yl] prop-2-enoate

Systemtic Name: [(3S,4S)-3-methylnon-1-en-4-yl] prop-2-enoate Openeye Name: [(1S)-1-[(1S)-1-methylallyl]hexyl] prop-2-enoate CAS Name: 2-propenoic acid [(3S,4S)-3-methylnon-1-en-4-yl] ester IUPAC Name: [(3S,4S)-3-methylnon-1-en-4-yl] prop-2-enoate Traditional Name: acrylic acid [(1S,2S)-1-amyl-2-methyl-but-3-enyl] ester Formula: C13H22O2 MolecularWeight: 210.31258

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(C)C=C)OC(=O)C=C

Isomeric SMILES

CCCCC[C@@H]([C@@H](C)C=C)OC(=O)C=C

InChI

InChI=1S/C13H22O2/c1-5-8-9-10-12(11(4)6-2)15-13(14)7-3/h6-7,11-12H,2-3,5,8-10H2,1,4H3/t11-,12-/m0/s1