[(3S)-3,7-dimethylocta-1,6-dien-3-yl] 4-chloranylbenzoate

Systemtic Name: [(3S)-3,7-dimethylocta-1,6-dien-3-yl] 4-chloranylbenzoate Openeye Name: [(1S)-1,5-dimethyl-1-vinyl-hex-4-enyl] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [(3S)-3,7-dimethylocta-1,6-dien-3-yl] ester IUPAC Name: [(3S)-3,7-dimethylocta-1,6-dien-3-yl] 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [(1S)-1,5-dimethyl-1-vinyl-hex-4-enyl] ester Formula: C17H21ClO2 MolecularWeight: 292.80044

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(C)(C=C)OC(=O)C1=CC=C(C=C1)Cl)C

Isomeric SMILES

CC(=CCC[C@@](C)(C=C)OC(=O)C1=CC=C(C=C1)Cl)C

InChI

InChI=1S/C17H21ClO2/c1-5-17(4,12-6-7-13(2)3)20-16(19)14-8-10-15(18)11-9-14/h5,7-11H,1,6,12H2,2-4H3/t17-/m1/s1