N-tert-butyl-4-(2-chloranyl-5-methyl-phenoxy)butan-1-amine; ethanedioic acid

Systemtic Name: N-tert-butyl-4-(2-chloranyl-5-methyl-phenoxy)butan-1-amine; ethanedioic acid Openeye Name: N-tert-butyl-4-(2-chloro-5-methyl-phenoxy)butan-1-amine; oxalic acid CAS Name: N-tert-butyl-4-(2-chloro-5-methylphenoxy)-1-butanamine; oxalic acid IUPAC Name: N-tert-butyl-4-(2-chloro-5-methylphenoxy)butan-1-amine; oxalic acid Traditional Name: tert-butyl-[4-(2-chloro-5-methyl-phenoxy)butyl]amine; oxalic acid Formula: C17H26ClNO5 MolecularWeight: 359.84504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)Cl)OCCCCNC(C)(C)C.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC(=C(C=C1)Cl)OCCCCNC(C)(C)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C15H24ClNO.C2H2O4/c1-12-7-8-13(16)14(11-12)18-10-6-5-9-17-15(2,3)4;3-1(4)2(5)6/h7-8,11,17H,5-6,9-10H2,1-4H3;(H,3,4)(H,5,6)