ethyl 3-(2-chloroethyl)-5-heptyl-2,4-dimethyl-6-oxidanyl-benzoate

Systemtic Name: ethyl 3-(2-chloroethyl)-5-heptyl-2,4-dimethyl-6-oxidanyl-benzoate Openeye Name: ethyl 5-(2-chloroethyl)-3-heptyl-2-hydroxy-4,6-dimethyl-benzoate CAS Name: 5-(2-chloroethyl)-3-heptyl-2-hydroxy-4,6-dimethylbenzoic acid ethyl ester IUPAC Name: ethyl 5-(2-chloroethyl)-3-heptyl-2-hydroxy-4,6-dimethylbenzoate Traditional Name: 5-(2-chloroethyl)-3-heptyl-2-hydroxy-4,6-dimethyl-benzoic acid ethyl ester Formula: C20H31ClO3 MolecularWeight: 354.91134

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=C(C(=C(C(=C1C)CCCl)C)C(=O)OCC)O

Isomeric SMILES

CCCCCCCC1=C(C(=C(C(=C1C)CCCl)C)C(=O)OCC)O

InChI

InChI=1S/C20H31ClO3/c1-5-7-8-9-10-11-17-14(3)16(12-13-21)15(4)18(19(17)22)20(23)24-6-2/h22H,5-13H2,1-4H3