4-[2,5-bis(chloranyl)phenoxy]-N-butyl-butan-1-amine; ethanedioic acid

Systemtic Name: 4-[2,5-bis(chloranyl)phenoxy]-N-butyl-butan-1-amine; ethanedioic acid Openeye Name: N-butyl-4-(2,5-dichlorophenoxy)butan-1-amine; oxalic acid CAS Name: N-butyl-4-(2,5-dichlorophenoxy)-1-butanamine; oxalic acid IUPAC Name: N-butyl-4-(2,5-dichlorophenoxy)butan-1-amine; oxalic acid Traditional Name: butyl-[4-(2,5-dichlorophenoxy)butyl]amine; oxalic acid Formula: C16H23Cl2NO5 MolecularWeight: 380.26352

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNCCCCOC1=C(C=CC(=C1)Cl)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

CCCCNCCCCOC1=C(C=CC(=C1)Cl)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C14H21Cl2NO.C2H2O4/c1-2-3-8-17-9-4-5-10-18-14-11-12(15)6-7-13(14)16;3-1(4)2(5)6/h6-7,11,17H,2-5,8-10H2,1H3;(H,3,4)(H,5,6)