4-[2-[1-ethyl-4-(4-fluorophenyl)-5-phenyl-2-propan-2-yl-pyrrol-3-yl]ethyl-oxidanyl-amino]-3-oxidanyl-butanoic acid

Systemtic Name: 4-[2-[1-ethyl-4-(4-fluorophenyl)-5-phenyl-2-propan-2-yl-pyrrol-3-yl]ethyl-oxidanyl-amino]-3-oxidanyl-butanoic acid Openeye Name: 4-[2-[1-ethyl-4-(4-fluorophenyl)-2-isopropyl-5-phenyl-pyrrol-3-yl]ethyl-hydroxy-amino]-3-hydroxy-butanoic acid CAS Name: 4-[2-[1-ethyl-4-(4-fluorophenyl)-5-phenyl-2-propan-2-yl-3-pyrrolyl]ethyl-hydroxyamino]-3-hydroxybutanoic acid IUPAC Name: 4-[2-[1-ethyl-4-(4-fluorophenyl)-5-phenyl-2-propan-2-ylpyrrol-3-yl]ethyl-hydroxyamino]-3-hydroxybutanoic acid Traditional Name: 4-[2-[1-ethyl-4-(4-fluorophenyl)-2-isopropyl-5-phenyl-pyrrol-3-yl]ethyl-hydroxy-amino]-3-hydroxy-butyric acid Formula: C27H33FN2O4 MolecularWeight: 468.560323

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=C1C(C)C)CCN(CC(CC(=O)O)O)O)C2=CC=C(C=C2)F)C3=CC=CC=C3

Isomeric SMILES

CCN1C(=C(C(=C1C(C)C)CCN(CC(CC(=O)O)O)O)C2=CC=C(C=C2)F)C3=CC=CC=C3

InChI

InChI=1S/C27H33FN2O4/c1-4-30-26(18(2)3)23(14-15-29(34)17-22(31)16-24(32)33)25(19-10-12-21(28)13-11-19)27(30)20-8-6-5-7-9-20/h5-13,18,22,31,34H,4,14-17H2,1-3H3,(H,32,33)