ethanedioic acid; N-[3-(2-iodanyl-4-methyl-phenoxy)propyl]cyclopentanamine

Systemtic Name: ethanedioic acid; N-[3-(2-iodanyl-4-methyl-phenoxy)propyl]cyclopentanamine Openeye Name: N-[3-(2-iodo-4-methyl-phenoxy)propyl]cyclopentanamine; oxalic acid CAS Name: N-[3-(2-iodo-4-methylphenoxy)propyl]cyclopentanamine; oxalic acid IUPAC Name: N-[3-(2-iodo-4-methylphenoxy)propyl]cyclopentanamine; oxalic acid Traditional Name: cyclopentyl-[3-(2-iodo-4-methyl-phenoxy)propyl]amine; oxalic acid Formula: C17H24INO5 MolecularWeight: 449.28063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCCCNC2CCCC2)I.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC(=C(C=C1)OCCCNC2CCCC2)I.C(=O)(C(=O)O)O

InChI

InChI=1S/C15H22INO.C2H2O4/c1-12-7-8-15(14(16)11-12)18-10-4-9-17-13-5-2-3-6-13;3-1(4)2(5)6/h7-8,11,13,17H,2-6,9-10H2,1H3;(H,3,4)(H,5,6)