ethanedioic acid; 2-[4-(4-methyl-2-prop-2-enyl-phenoxy)butylamino]ethanol

Systemtic Name: ethanedioic acid; 2-[4-(4-methyl-2-prop-2-enyl-phenoxy)butylamino]ethanol Openeye Name: 2-[4-(2-allyl-4-methyl-phenoxy)butylamino]ethanol; oxalic acid CAS Name: 2-[4-(4-methyl-2-prop-2-enylphenoxy)butylamino]ethanol; oxalic acid IUPAC Name: 2-[4-(4-methyl-2-prop-2-enylphenoxy)butylamino]ethanol; oxalic acid Traditional Name: 2-[4-(2-allyl-4-methyl-phenoxy)butylamino]ethanol; oxalic acid Formula: C18H27NO6 MolecularWeight: 353.41008

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H25NO2.C2H2O4/c1-3-6-15-13-14(2)7-8-16(15)19-12-5-4-9-17-10-11-18;3-1(4)2(5)6/h3,7-8,13,17-18H,1,4-6,9-12H2,2H3;(H,3,4)(H,5,6)