4-(1-chloranyl-3-oxidanylidene-nonan-4-yl)oxybenzoic acid

Systemtic Name: 4-(1-chloranyl-3-oxidanylidene-nonan-4-yl)oxybenzoic acid Openeye Name: 4-[1-(3-chloropropanoyl)hexoxy]benzoic acid CAS Name: 4-(1-chloro-3-oxononan-4-yl)oxybenzoic acid IUPAC Name: 4-(1-chloro-3-oxononan-4-yl)oxybenzoic acid Traditional Name: 4-[1-(3-chloropropanoyl)hexoxy]benzoic acid Formula: C16H21ClO4 MolecularWeight: 312.78854

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(=O)CCCl)OC1=CC=C(C=C1)C(=O)O

Isomeric SMILES

CCCCCC(C(=O)CCCl)OC1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C16H21ClO4/c1-2-3-4-5-15(14(18)10-11-17)21-13-8-6-12(7-9-13)16(19)20/h6-9,15H,2-5,10-11H2,1H3,(H,19,20)