N-butyl-4-(3-methyl-4-propan-2-yl-phenoxy)butan-1-amine; ethanedioic acid

Systemtic Name: N-butyl-4-(3-methyl-4-propan-2-yl-phenoxy)butan-1-amine; ethanedioic acid Openeye Name: N-butyl-4-(4-isopropyl-3-methyl-phenoxy)butan-1-amine; oxalic acid CAS Name: N-butyl-4-(3-methyl-4-propan-2-ylphenoxy)-1-butanamine; oxalic acid IUPAC Name: N-butyl-4-(3-methyl-4-propan-2-ylphenoxy)butan-1-amine; oxalic acid Traditional Name: butyl-[4-(4-isopropyl-3-methyl-phenoxy)butyl]amine; oxalic acid Formula: C20H33NO5 MolecularWeight: 367.47972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H31NO.C2H2O4/c1-5-6-11-19-12-7-8-13-20-17-9-10-18(15(2)3)16(4)14-17;3-1(4)2(5)6/h9-10,14-15,19H,5-8,11-13H2,1-4H3;(H,3,4)(H,5,6)