4-fluoranyl-1-[3-[(2-methyl-3-oxidanyl-phenyl)carbonylamino]-2-oxidanyl-4-phenyl-butanoyl]-N-(2-piperidin-1-ylethyl)pyrrolidine-2-carboxamide

Systemtic Name: 4-fluoranyl-1-[3-[(2-methyl-3-oxidanyl-phenyl)carbonylamino]-2-oxidanyl-4-phenyl-butanoyl]-N-(2-piperidin-1-ylethyl)pyrrolidine-2-carboxamide Openeye Name: 4-fluoro-1-[2-hydroxy-3-[(3-hydroxy-2-methyl-benzoyl)amino]-4-phenyl-butanoyl]-N-[2-(1-piperidyl)ethyl]pyrrolidine-2-carboxamide CAS Name: 4-fluoro-1-[2-hydroxy-3-[[(3-hydroxy-2-methylphenyl)-oxomethyl]amino]-1-oxo-4-phenylbutyl]-N-[2-(1-piperidinyl)ethyl]-2-pyrrolidinecarboxamide IUPAC Name: 4-fluoro-1-[2-hydroxy-3-[(3-hydroxy-2-methylbenzoyl)amino]-4-phenylbutanoyl]-N-(2-piperidin-1-ylethyl)pyrrolidine-2-carboxamide Traditional Name: 4-fluoro-1-[2-hydroxy-3-[(3-hydroxy-2-methyl-benzoyl)amino]-4-phenyl-butanoyl]-N-(2-piperidinoethyl)pyrrolidine-2-carboxamide Formula: C30H39FN4O5 MolecularWeight: 554.652863

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1O)C(=O)NC(CC2=CC=CC=C2)C(C(=O)N3CC(CC3C(=O)NCCN4CCCCC4)F)O

Isomeric SMILES

CC1=C(C=CC=C1O)C(=O)NC(CC2=CC=CC=C2)C(C(=O)N3CC(CC3C(=O)NCCN4CCCCC4)F)O

InChI

InChI=1S/C30H39FN4O5/c1-20-23(11-8-12-26(20)36)28(38)33-24(17-21-9-4-2-5-10-21)27(37)30(40)35-19-22(31)18-25(35)29(39)32-13-16-34-14-6-3-7-15-34/h2,4-5,8-12,22,24-25,27,36-37H,3,6-7,13-19H2,1H3,(H,32,39)(H,33,38)