ethanedioic acid; N-[3-(2-methyl-6-prop-2-enyl-phenoxy)propyl]butan-2-amine

Systemtic Name: ethanedioic acid; N-[3-(2-methyl-6-prop-2-enyl-phenoxy)propyl]butan-2-amine Openeye Name: N-[3-(2-allyl-6-methyl-phenoxy)propyl]butan-2-amine; oxalic acid CAS Name: N-[3-(2-methyl-6-prop-2-enylphenoxy)propyl]-2-butanamine; oxalic acid IUPAC Name: N-[3-(2-methyl-6-prop-2-enylphenoxy)propyl]butan-2-amine; oxalic acid Traditional Name: 3-(2-allyl-6-methyl-phenoxy)propyl-sec-butyl-amine; oxalic acid Formula: C19H29NO5 MolecularWeight: 351.43726

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NCCCOC1=C(C=CC=C1CC=C)C.C(=O)(C(=O)O)O

Isomeric SMILES

CCC(C)NCCCOC1=C(C=CC=C1CC=C)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H27NO.C2H2O4/c1-5-9-16-11-7-10-14(3)17(16)19-13-8-12-18-15(4)6-2;3-1(4)2(5)6/h5,7,10-11,15,18H,1,6,8-9,12-13H2,2-4H3;(H,3,4)(H,5,6)