(3R,5R)-7-[2-(4-fluorophenyl)-4-(1H-indol-5-ylcarbamoyl)-3-phenyl-5-propan-2-yl-pyrrol-1-yl]-3,5-bis(oxidanyl)heptanoic acid

Systemtic Name: (3R,5R)-7-[2-(4-fluorophenyl)-4-(1H-indol-5-ylcarbamoyl)-3-phenyl-5-propan-2-yl-pyrrol-1-yl]-3,5-bis(oxidanyl)heptanoic acid Openeye Name: (3R,5R)-7-[2-(4-fluorophenyl)-4-(1H-indol-5-ylcarbamoyl)-5-isopropyl-3-phenyl-pyrrol-1-yl]-3,5-dihydroxy-heptanoic acid CAS Name: (3R,5R)-7-[2-(4-fluorophenyl)-4-[(1H-indol-5-ylamino)-oxomethyl]-3-phenyl-5-propan-2-yl-1-pyrrolyl]-3,5-dihydroxyheptanoic acid IUPAC Name: (3R,5R)-7-[2-(4-fluorophenyl)-4-(1H-indol-5-ylcarbamoyl)-3-phenyl-5-propan-2-ylpyrrol-1-yl]-3,5-dihydroxyheptanoic acid Traditional Name: (3R,5R)-7-[2-(4-fluorophenyl)-4-(1H-indol-5-ylcarbamoyl)-5-isopropyl-3-phenyl-pyrrol-1-yl]-3,5-dihydroxy-enanthic acid Formula: C35H36FN3O5 MolecularWeight: 597.675843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=C(N1CCC(CC(CC(=O)O)O)O)C2=CC=C(C=C2)F)C3=CC=CC=C3)C(=O)NC4=CC5=C(C=C4)NC=C5

Isomeric SMILES

CC(C)C1=C(C(=C(N1CC[C@H](C[C@H](CC(=O)O)O)O)C2=CC=C(C=C2)F)C3=CC=CC=C3)C(=O)NC4=CC5=C(C=C4)NC=C5

InChI

InChI=1S/C35H36FN3O5/c1-21(2)33-32(35(44)38-26-12-13-29-24(18-26)14-16-37-29)31(22-6-4-3-5-7-22)34(23-8-10-25(36)11-9-23)39(33)17-15-27(40)19-28(41)20-30(42)43/h3-14,16,18,21,27-28,37,40-41H,15,17,19-20H2,1-2H3,(H,38,44)(H,42,43)/t27-,28-/m1/s1