4-(4-fluorophenyl)-2-imidazol-1-yl-4-[3-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]-5-oxidanyl-3-oxidanylidene-2-propan-2-yl-hept-6-enoic acid

Systemtic Name: 4-(4-fluorophenyl)-2-imidazol-1-yl-4-[3-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]-5-oxidanyl-3-oxidanylidene-2-propan-2-yl-hept-6-enoic acid Openeye Name: 4-[3-(tert-butoxycarbonylamino)phenyl]-4-(4-fluorophenyl)-5-hydroxy-2-imidazol-1-yl-2-isopropyl-3-oxo-hept-6-enoic acid CAS Name: 4-(4-fluorophenyl)-5-hydroxy-2-(1-imidazolyl)-4-[3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]phenyl]-3-oxo-2-propan-2-yl-6-heptenoic acid IUPAC Name: 4-(4-fluorophenyl)-5-hydroxy-2-imidazol-1-yl-4-[3-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]-3-oxo-2-propan-2-ylhept-6-enoic acid Traditional Name: 4-[3-(tert-butoxycarbonylamino)phenyl]-4-(4-fluorophenyl)-5-hydroxy-2-imidazol-1-yl-2-isopropyl-3-keto-hept-6-enoic acid Formula: C30H34FN3O6 MolecularWeight: 551.605863

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)C(C1=CC=C(C=C1)F)(C2=CC(=CC=C2)NC(=O)OC(C)(C)C)C(C=C)O)(C(=O)O)N3C=CN=C3

Isomeric SMILES

CC(C)C(C(=O)C(C1=CC=C(C=C1)F)(C2=CC(=CC=C2)NC(=O)OC(C)(C)C)C(C=C)O)(C(=O)O)N3C=CN=C3

InChI

InChI=1S/C30H34FN3O6/c1-7-24(35)29(20-11-13-22(31)14-12-20,21-9-8-10-23(17-21)33-27(39)40-28(4,5)6)25(36)30(19(2)3,26(37)38)34-16-15-32-18-34/h7-19,24,35H,1H2,2-6H3,(H,33,39)(H,37,38)