ethanedioic acid; N-[2-(2-methyl-6-prop-2-enyl-phenoxy)ethyl]butan-1-amine

Systemtic Name: ethanedioic acid; N-[2-(2-methyl-6-prop-2-enyl-phenoxy)ethyl]butan-1-amine Openeye Name: N-[2-(2-allyl-6-methyl-phenoxy)ethyl]butan-1-amine; oxalic acid CAS Name: N-[2-(2-methyl-6-prop-2-enylphenoxy)ethyl]-1-butanamine; oxalic acid IUPAC Name: N-[2-(2-methyl-6-prop-2-enylphenoxy)ethyl]butan-1-amine; oxalic acid Traditional Name: 2-(2-allyl-6-methyl-phenoxy)ethyl-butyl-amine; oxalic acid Formula: C18H27NO5 MolecularWeight: 337.41068

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNCCOC1=C(C=CC=C1CC=C)C.C(=O)(C(=O)O)O

Isomeric SMILES

CCCCNCCOC1=C(C=CC=C1CC=C)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H25NO.C2H2O4/c1-4-6-11-17-12-13-18-16-14(3)9-7-10-15(16)8-5-2;3-1(4)2(5)6/h5,7,9-10,17H,2,4,6,8,11-13H2,1,3H3;(H,3,4)(H,5,6)