5-azanyl-1-(2,4-dichlorophenyl)-2,2-dimethyl-octan-3-one; ethanedioic acid

Systemtic Name: 5-azanyl-1-(2,4-dichlorophenyl)-2,2-dimethyl-octan-3-one; ethanedioic acid Openeye Name: 5-amino-1-(2,4-dichlorophenyl)-2,2-dimethyl-octan-3-one; oxalic acid CAS Name: 5-amino-1-(2,4-dichlorophenyl)-2,2-dimethyl-3-octanone; oxalic acid IUPAC Name: 5-amino-1-(2,4-dichlorophenyl)-2,2-dimethyloctan-3-one; oxalic acid Traditional Name: 5-amino-1-(2,4-dichlorophenyl)-2,2-dimethyl-octan-3-one; oxalic acid Formula: C18H25Cl2NO5 MolecularWeight: 406.3008

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC(=O)C(C)(C)CC1=C(C=C(C=C1)Cl)Cl)N.C(=O)(C(=O)O)O

Isomeric SMILES

CCCC(CC(=O)C(C)(C)CC1=C(C=C(C=C1)Cl)Cl)N.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H23Cl2NO.C2H2O4/c1-4-5-13(19)9-15(20)16(2,3)10-11-6-7-12(17)8-14(11)18;3-1(4)2(5)6/h6-8,13H,4-5,9-10,19H2,1-3H3;(H,3,4)(H,5,6)