N-butan-2-yl-4-(2,5-dimethylphenoxy)butan-1-amine; ethanedioic acid

Systemtic Name: N-butan-2-yl-4-(2,5-dimethylphenoxy)butan-1-amine; ethanedioic acid Openeye Name: 4-(2,5-dimethylphenoxy)-N-sec-butyl-butan-1-amine; oxalic acid CAS Name: N-butan-2-yl-4-(2,5-dimethylphenoxy)-1-butanamine; oxalic acid IUPAC Name: N-butan-2-yl-4-(2,5-dimethylphenoxy)butan-1-amine; oxalic acid Traditional Name: 4-(2,5-dimethylphenoxy)butyl-sec-butyl-amine; oxalic acid Formula: C18H29NO5 MolecularWeight: 339.42656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H27NO.C2H2O4/c1-5-15(4)17-10-6-7-11-18-16-12-13(2)8-9-14(16)3;3-1(4)2(5)6/h8-9,12,15,17H,5-7,10-11H2,1-4H3;(H,3,4)(H,5,6)