ethanedioic acid; N-[3-(3-methyl-5-propan-2-yl-phenoxy)propyl]butan-1-amine

Systemtic Name: ethanedioic acid; N-[3-(3-methyl-5-propan-2-yl-phenoxy)propyl]butan-1-amine Openeye Name: N-[3-(3-isopropyl-5-methyl-phenoxy)propyl]butan-1-amine; oxalic acid CAS Name: N-[3-(3-methyl-5-propan-2-ylphenoxy)propyl]-1-butanamine; oxalic acid IUPAC Name: N-[3-(3-methyl-5-propan-2-ylphenoxy)propyl]butan-1-amine; oxalic acid Traditional Name: butyl-[3-(3-isopropyl-5-methyl-phenoxy)propyl]amine; oxalic acid Formula: C19H31NO5 MolecularWeight: 353.45314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H29NO.C2H2O4/c1-5-6-8-18-9-7-10-19-17-12-15(4)11-16(13-17)14(2)3;3-1(4)2(5)6/h11-14,18H,5-10H2,1-4H3;(H,3,4)(H,5,6)