2-chloranyl-4-(4-heptoxyphenyl)carbonyloxy-benzoic acid

Systemtic Name: 2-chloranyl-4-(4-heptoxyphenyl)carbonyloxy-benzoic acid Openeye Name: 2-chloro-4-(4-heptoxybenzoyl)oxy-benzoic acid CAS Name: 2-chloro-4-[(4-heptoxyphenyl)-oxomethoxy]benzoic acid IUPAC Name: 2-chloro-4-(4-heptoxybenzoyl)oxybenzoic acid Traditional Name: 2-chloro-4-(4-heptoxybenzoyl)oxy-benzoic acid Formula: C21H23ClO5 MolecularWeight: 390.85732

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC(=C(C=C2)C(=O)O)Cl

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC(=C(C=C2)C(=O)O)Cl

InChI

InChI=1S/C21H23ClO5/c1-2-3-4-5-6-13-26-16-9-7-15(8-10-16)21(25)27-17-11-12-18(20(23)24)19(22)14-17/h7-12,14H,2-6,13H2,1H3,(H,23,24)