(Z)-6-[4-[4-(4-cyclohexylbutylcarbamoyl)-1,3-oxazol-2-yl]phenyl]-6-iodanyl-hex-5-enoate

Systemtic Name: (Z)-6-[4-[4-(4-cyclohexylbutylcarbamoyl)-1,3-oxazol-2-yl]phenyl]-6-iodanyl-hex-5-enoate Openeye Name: (Z)-6-[4-[4-(4-cyclohexylbutylcarbamoyl)oxazol-2-yl]phenyl]-6-iodo-hex-5-enoate CAS Name: (Z)-6-[4-[4-[(4-cyclohexylbutylamino)-oxomethyl]-2-oxazolyl]phenyl]-6-iodo-5-hexenoate IUPAC Name: (Z)-6-[4-[4-(4-cyclohexylbutylcarbamoyl)-1,3-oxazol-2-yl]phenyl]-6-iodohex-5-enoate Traditional Name: (Z)-6-[4-[4-(4-cyclohexylbutylcarbamoyl)oxazol-2-yl]phenyl]-6-iodo-hex-5-enoate Formula: C26H32IN2O4- MolecularWeight: 563.44775

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCCCNC(=O)C2=COC(=N2)C3=CC=C(C=C3)C(=CCCCC(=O)[O-])I

Isomeric SMILES

C1CCC(CC1)CCCCNC(=O)C2=COC(=N2)C3=CC=C(C=C3)/C(=C/CCCC(=O)[O-])/I

InChI

InChI=1S/C26H33IN2O4/c27-22(11-4-5-12-24(30)31)20-13-15-21(16-14-20)26-29-23(18-33-26)25(32)28-17-7-6-10-19-8-2-1-3-9-19/h11,13-16,18-19H,1-10,12,17H2,(H,28,32)(H,30,31)/p-1/b22-11-