N-[2-(4-chloranyl-2-prop-2-enyl-phenoxy)ethyl]-3-methoxy-propan-1-amine; ethanedioic acid

Systemtic Name: N-[2-(4-chloranyl-2-prop-2-enyl-phenoxy)ethyl]-3-methoxy-propan-1-amine; ethanedioic acid Openeye Name: N-[2-(2-allyl-4-chloro-phenoxy)ethyl]-3-methoxy-propan-1-amine; oxalic acid CAS Name: N-[2-(4-chloro-2-prop-2-enylphenoxy)ethyl]-3-methoxy-1-propanamine; oxalic acid IUPAC Name: N-[2-(4-chloro-2-prop-2-enylphenoxy)ethyl]-3-methoxypropan-1-amine; oxalic acid Traditional Name: 2-(2-allyl-4-chloro-phenoxy)ethyl-(3-methoxypropyl)amine; oxalic acid Formula: C17H24ClNO6 MolecularWeight: 373.82856

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNCCOC1=C(C=C(C=C1)Cl)CC=C.C(=O)(C(=O)O)O

Isomeric SMILES

COCCCNCCOC1=C(C=C(C=C1)Cl)CC=C.C(=O)(C(=O)O)O

InChI

InChI=1S/C15H22ClNO2.C2H2O4/c1-3-5-13-12-14(16)6-7-15(13)19-11-9-17-8-4-10-18-2;3-1(4)2(5)6/h3,6-7,12,17H,1,4-5,8-11H2,2H3;(H,3,4)(H,5,6)