4-[3,4-bis(chloranyl)phenoxy]-N-propan-2-yl-butan-1-amine; ethanedioic acid

Systemtic Name: 4-[3,4-bis(chloranyl)phenoxy]-N-propan-2-yl-butan-1-amine; ethanedioic acid Openeye Name: 4-(3,4-dichlorophenoxy)-N-isopropyl-butan-1-amine; oxalic acid CAS Name: 4-(3,4-dichlorophenoxy)-N-propan-2-yl-1-butanamine; oxalic acid IUPAC Name: 4-(3,4-dichlorophenoxy)-N-propan-2-ylbutan-1-amine; oxalic acid Traditional Name: 4-(3,4-dichlorophenoxy)butyl-isopropyl-amine; oxalic acid Formula: C15H21Cl2NO5 MolecularWeight: 366.23694

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCCCCOC1=CC(=C(C=C1)Cl)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C)NCCCCOC1=CC(=C(C=C1)Cl)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C13H19Cl2NO.C2H2O4/c1-10(2)16-7-3-4-8-17-11-5-6-12(14)13(15)9-11;3-1(4)2(5)6/h5-6,9-10,16H,3-4,7-8H2,1-2H3;(H,3,4)(H,5,6)