2-[2-(4-azido-3-iodanyl-phenyl)ethyl]-8-[4-(4-fluorophenyl)-4-oxidanylidene-butyl]-4-phenyl-2,4,8-triazaspiro[4.5]decan-1-one

Systemtic Name: 2-[2-(4-azido-3-iodanyl-phenyl)ethyl]-8-[4-(4-fluorophenyl)-4-oxidanylidene-butyl]-4-phenyl-2,4,8-triazaspiro[4.5]decan-1-one Openeye Name: 2-[2-(4-azido-3-iodanyl-phenyl)ethyl]-8-[4-(4-fluorophenyl)-4-oxo-butyl]-4-phenyl-2,4,8-triazaspiro[4.5]decan-1-one CAS Name: 2-[2-(4-azido-3-iodanylphenyl)ethyl]-8-[4-(4-fluorophenyl)-4-oxobutyl]-4-phenyl-2,4,8-triazaspiro[4.5]decan-1-one IUPAC Name: 2-[2-(4-azido-3-iodanylphenyl)ethyl]-8-[4-(4-fluorophenyl)-4-oxobutyl]-4-phenyl-2,4,8-triazaspiro[4.5]decan-1-one Traditional Name: 2-[2-(4-azido-3-iodanyl-phenyl)ethyl]-8-[4-(4-fluorophenyl)-4-keto-butyl]-4-phenyl-2,4,8-triazaspiro[4.5]decan-1-one Formula: C31H32FIN6O2 MolecularWeight: 664.527807

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC12C(=O)N(CN2C3=CC=CC=C3)CCC4=CC(=C(C=C4)N=[N+]=[N-])I)CCCC(=O)C5=CC=C(C=C5)F

Isomeric SMILES

C1CN(CCC12C(=O)N(CN2C3=CC=CC=C3)CCC4=CC(=C(C=C4)N=[N+]=[N-])[125I])CCCC(=O)C5=CC=C(C=C5)F

InChI

InChI=1S/C31H32FIN6O2/c32-25-11-9-24(10-12-25)29(40)7-4-17-37-19-15-31(16-20-37)30(41)38(22-39(31)26-5-2-1-3-6-26)18-14-23-8-13-28(35-36-34)27(33)21-23/h1-3,5-6,8-13,21H,4,7,14-20,22H2/i33-2