N-[3-(2-tert-butyl-4-chloranyl-phenoxy)propyl]butan-1-amine; ethanedioic acid

Systemtic Name: N-[3-(2-tert-butyl-4-chloranyl-phenoxy)propyl]butan-1-amine; ethanedioic acid Openeye Name: N-[3-(2-tert-butyl-4-chloro-phenoxy)propyl]butan-1-amine; oxalic acid CAS Name: N-[3-(2-tert-butyl-4-chlorophenoxy)propyl]-1-butanamine; oxalic acid IUPAC Name: N-[3-(2-tert-butyl-4-chlorophenoxy)propyl]butan-1-amine; oxalic acid Traditional Name: butyl-[3-(2-tert-butyl-4-chloro-phenoxy)propyl]amine; oxalic acid Formula: C19H30ClNO5 MolecularWeight: 387.8982

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNCCCOC1=C(C=C(C=C1)Cl)C(C)(C)C.C(=O)(C(=O)O)O

Isomeric SMILES

CCCCNCCCOC1=C(C=C(C=C1)Cl)C(C)(C)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H28ClNO.C2H2O4/c1-5-6-10-19-11-7-12-20-16-9-8-14(18)13-15(16)17(2,3)4;3-1(4)2(5)6/h8-9,13,19H,5-7,10-12H2,1-4H3;(H,3,4)(H,5,6)