propan-2-yl 7-chloranyl-2-ethanoyl-heptanoate

Systemtic Name: propan-2-yl 7-chloranyl-2-ethanoyl-heptanoate Openeye Name: isopropyl 2-acetyl-7-chloro-heptanoate CAS Name: 2-acetyl-7-chloroheptanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-acetyl-7-chloroheptanoate Traditional Name: 2-acetyl-7-chloro-enanthic acid isopropyl ester Formula: C12H21ClO3 MolecularWeight: 248.74634

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C(CCCCCCl)C(=O)C

Isomeric SMILES

CC(C)OC(=O)C(CCCCCCl)C(=O)C

InChI

InChI=1S/C12H21ClO3/c1-9(2)16-12(15)11(10(3)14)7-5-4-6-8-13/h9,11H,4-8H2,1-3H3