octan-3-yl 2-carbonochloridoylbenzoate

Systemtic Name: octan-3-yl 2-carbonochloridoylbenzoate Openeye Name: 1-ethylhexyl 2-chlorocarbonylbenzoate CAS Name: 2-carbonochloridoylbenzoic acid octan-3-yl ester IUPAC Name: octan-3-yl 2-carbonochloridoylbenzoate Traditional Name: 2-chlorocarbonylbenzoic acid 1-ethylhexyl ester Formula: C16H21ClO3 MolecularWeight: 296.78914

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)OC(=O)C1=CC=CC=C1C(=O)Cl

Isomeric SMILES

CCCCCC(CC)OC(=O)C1=CC=CC=C1C(=O)Cl

InChI

InChI=1S/C16H21ClO3/c1-3-5-6-9-12(4-2)20-16(19)14-11-8-7-10-13(14)15(17)18/h7-8,10-12H,3-6,9H2,1-2H3