2-chloranyl-6-[(1S,3S)-3-methylcyclohexyl]oxy-benzoate

Systemtic Name: 2-chloranyl-6-[(1S,3S)-3-methylcyclohexyl]oxy-benzoate Openeye Name: 2-chloro-6-[(1S,3S)-3-methylcyclohexoxy]benzoate CAS Name: 2-chloro-6-[(1S,3S)-3-methylcyclohexyl]oxybenzoate IUPAC Name: 2-chloro-6-[(1S,3S)-3-methylcyclohexyl]oxybenzoate Traditional Name: 2-chloro-6-[(1S,3S)-3-methylcyclohexoxy]benzoate Formula: C14H16ClO3- MolecularWeight: 267.72804

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1)OC2=C(C(=CC=C2)Cl)C(=O)[O-]

Isomeric SMILES

C[C@H]1CCC[C@@H](C1)OC2=C(C(=CC=C2)Cl)C(=O)[O-]

InChI

InChI=1S/C14H17ClO3/c1-9-4-2-5-10(8-9)18-12-7-3-6-11(15)13(12)14(16)17/h3,6-7,9-10H,2,4-5,8H2,1H3,(H,16,17)/p-1/t9-,10-/m0/s1