phenyl (E)-2-[4-(4-cyclohexylbutylcarbamoyl)-1,3-oxazol-2-yl]-7-pyridin-3-yl-hept-6-enoate

Systemtic Name: phenyl (E)-2-[4-(4-cyclohexylbutylcarbamoyl)-1,3-oxazol-2-yl]-7-pyridin-3-yl-hept-6-enoate Openeye Name: phenyl (E)-2-[4-(4-cyclohexylbutylcarbamoyl)oxazol-2-yl]-7-(3-pyridyl)hept-6-enoate CAS Name: (E)-2-[4-[(4-cyclohexylbutylamino)-oxomethyl]-2-oxazolyl]-7-(3-pyridinyl)-6-heptenoic acid phenyl ester IUPAC Name: phenyl (E)-2-[4-(4-cyclohexylbutylcarbamoyl)-1,3-oxazol-2-yl]-7-pyridin-3-ylhept-6-enoate Traditional Name: (E)-2-[4-(4-cyclohexylbutylcarbamoyl)oxazol-2-yl]-7-(3-pyridyl)hept-6-enoic acid phenyl ester Formula: C32H39N3O4 MolecularWeight: 529.66976

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCCCNC(=O)C2=COC(=N2)C(CCCC=CC3=CN=CC=C3)C(=O)OC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)CCCCNC(=O)C2=COC(=N2)C(CCC/C=C/C3=CN=CC=C3)C(=O)OC4=CC=CC=C4

InChI

InChI=1S/C32H39N3O4/c36-30(34-22-11-10-15-25-13-4-1-5-14-25)29-24-38-31(35-29)28(32(37)39-27-18-7-3-8-19-27)20-9-2-6-16-26-17-12-21-33-23-26/h3,6-8,12,16-19,21,23-25,28H,1-2,4-5,9-11,13-15,20,22H2,(H,34,36)/b16-6+