7-[2-[3-(4-azido-3-iodanyl-phenyl)propylamino]cyclopentyl]heptanoic acid

Systemtic Name: 7-[2-[3-(4-azido-3-iodanyl-phenyl)propylamino]cyclopentyl]heptanoic acid Openeye Name: 7-[2-[3-(4-azido-3-iodanyl-phenyl)propylamino]cyclopentyl]heptanoic acid CAS Name: 7-[2-[3-(4-azido-3-iodanylphenyl)propylamino]cyclopentyl]heptanoic acid IUPAC Name: 7-[2-[3-(4-azido-3-iodanylphenyl)propylamino]cyclopentyl]heptanoic acid Traditional Name: 7-[2-[3-(4-azido-3-iodanyl-phenyl)propylamino]cyclopentyl]enanthic acid Formula: C21H31IN4O2 MolecularWeight: 498.400908

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(C1)NCCCC2=CC(=C(C=C2)N=[N+]=[N-])I)CCCCCCC(=O)O

Isomeric SMILES

C1CC(C(C1)NCCCC2=CC(=C(C=C2)N=[N+]=[N-])[127I])CCCCCCC(=O)O

InChI

InChI=1S/C21H31IN4O2/c22-18-15-16(12-13-20(18)25-26-23)7-6-14-24-19-10-5-9-17(19)8-3-1-2-4-11-21(27)28/h12-13,15,17,19,24H,1-11,14H2,(H,27,28)/i22+0