2-[2,4-bis(chloranyl)phenoxy]ethanoic acid; heptan-1-amine

Systemtic Name: 2-[2,4-bis(chloranyl)phenoxy]ethanoic acid; heptan-1-amine Openeye Name: 2-(2,4-dichlorophenoxy)acetic acid; heptan-1-amine CAS Name: 2-(2,4-dichlorophenoxy)acetic acid; 1-heptanamine IUPAC Name: 2-(2,4-dichlorophenoxy)acetic acid; heptan-1-amine Traditional Name: 2-(2,4-dichlorophenoxy)acetic acid; heptylamine Formula: C15H23Cl2NO3 MolecularWeight: 336.25402

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN.C1=CC(=C(C=C1Cl)Cl)OCC(=O)O

Isomeric SMILES

CCCCCCCN.C1=CC(=C(C=C1Cl)Cl)OCC(=O)O

InChI

InChI=1S/C8H6Cl2O3.C7H17N/c9-5-1-2-7(6(10)3-5)13-4-8(11)12;1-2-3-4-5-6-7-8/h1-3H,4H2,(H,11,12);2-8H2,1H3