4-(2,6-dimethylphenoxy)-N-(oxolan-2-ylmethyl)butan-1-amine; ethanedioic acid

Systemtic Name: 4-(2,6-dimethylphenoxy)-N-(oxolan-2-ylmethyl)butan-1-amine; ethanedioic acid Openeye Name: 4-(2,6-dimethylphenoxy)-N-(tetrahydrofuran-2-ylmethyl)butan-1-amine; oxalic acid CAS Name: 4-(2,6-dimethylphenoxy)-N-(2-oxolanylmethyl)-1-butanamine; oxalic acid IUPAC Name: 4-(2,6-dimethylphenoxy)-N-(oxolan-2-ylmethyl)butan-1-amine; oxalic acid Traditional Name: 4-(2,6-dimethylphenoxy)butyl-(tetrahydrofurfuryl)amine; oxalic acid Formula: C19H29NO6 MolecularWeight: 367.43666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCCCCNCC2CCCO2.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCCCCNCC2CCCO2.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H27NO2.C2H2O4/c1-14-7-5-8-15(2)17(14)20-11-4-3-10-18-13-16-9-6-12-19-16;3-1(4)2(5)6/h5,7-8,16,18H,3-4,6,9-13H2,1-2H3;(H,3,4)(H,5,6)