4-(3-chloranyl-4-dodecoxy-phenyl)carbonyloxybenzoic acid; nonan-2-ol

Systemtic Name: 4-(3-chloranyl-4-dodecoxy-phenyl)carbonyloxybenzoic acid; nonan-2-ol Openeye Name: 4-(3-chloro-4-dodecoxy-benzoyl)oxybenzoic acid; nonan-2-ol CAS Name: 4-[(3-chloro-4-dodecoxyphenyl)-oxomethoxy]benzoic acid; 2-nonanol IUPAC Name: 4-(3-chloro-4-dodecoxybenzoyl)oxybenzoic acid; nonan-2-ol Traditional Name: 4-(3-chloro-4-lauryloxy-benzoyl)oxybenzoic acid; nonan-2-ol Formula: C35H53ClO6 MolecularWeight: 605.24472

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)O)Cl.CCCCCCCC(C)O

Isomeric SMILES

CCCCCCCCCCCCOC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)O)Cl.CCCCCCCC(C)O

InChI

InChI=1S/C26H33ClO5.C9H20O/c1-2-3-4-5-6-7-8-9-10-11-18-31-24-17-14-21(19-23(24)27)26(30)32-22-15-12-20(13-16-22)25(28)29;1-3-4-5-6-7-8-9(2)10/h12-17,19H,2-11,18H2,1H3,(H,28,29);9-10H,3-8H2,1-2H3