ethanedioic acid; N-[1-(2-iodanyl-5-methoxy-phenyl)propan-2-yl]-N-methyl-4-phenyl-butan-1-amine

Systemtic Name: ethanedioic acid; N-[1-(2-iodanyl-5-methoxy-phenyl)propan-2-yl]-N-methyl-4-phenyl-butan-1-amine Openeye Name: N-[2-(2-iodo-5-methoxy-phenyl)-1-methyl-ethyl]-N-methyl-4-phenyl-butan-1-amine; oxalic acid CAS Name: N-[1-(2-iodo-5-methoxyphenyl)propan-2-yl]-N-methyl-4-phenyl-1-butanamine; oxalic acid IUPAC Name: N-[1-(2-iodo-5-methoxyphenyl)propan-2-yl]-N-methyl-4-phenylbutan-1-amine; oxalic acid Traditional Name: [2-(2-iodo-5-methoxy-phenyl)-1-methyl-ethyl]-methyl-(4-phenylbutyl)amine; oxalic acid Formula: C23H30INO5 MolecularWeight: 527.39247

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=C(C=CC(=C1)OC)I)N(C)CCCCC2=CC=CC=C2.C(=O)(C(=O)O)O

Isomeric SMILES

CC(CC1=C(C=CC(=C1)OC)I)N(C)CCCCC2=CC=CC=C2.C(=O)(C(=O)O)O

InChI

InChI=1S/C21H28INO.C2H2O4/c1-17(15-19-16-20(24-3)12-13-21(19)22)23(2)14-8-7-11-18-9-5-4-6-10-18;3-1(4)2(5)6/h4-6,9-10,12-13,16-17H,7-8,11,14-15H2,1-3H3;(H,3,4)(H,5,6)