N-cyclopropyl-3-[4-(2,2-dimethylpropylcarbamoyl)-2-(4-oxidanylpiperidin-1-yl)carbonyl-phenyl]-5-fluoranyl-4-methyl-benzamide

Systemtic Name: N-cyclopropyl-3-[4-(2,2-dimethylpropylcarbamoyl)-2-(4-oxidanylpiperidin-1-yl)carbonyl-phenyl]-5-fluoranyl-4-methyl-benzamide Openeye Name: N-cyclopropyl-3-[4-(2,2-dimethylpropylcarbamoyl)-2-(4-hydroxypiperidine-1-carbonyl)phenyl]-5-fluoro-4-methyl-benzamide CAS Name: N-cyclopropyl-3-[4-[(2,2-dimethylpropylamino)-oxomethyl]-2-[(4-hydroxy-1-piperidinyl)-oxomethyl]phenyl]-5-fluoro-4-methylbenzamide IUPAC Name: N-cyclopropyl-3-[4-(2,2-dimethylpropylcarbamoyl)-2-(4-hydroxypiperidine-1-carbonyl)phenyl]-5-fluoro-4-methylbenzamide Traditional Name: N-cyclopropyl-3-fluoro-5-[2-(4-hydroxypiperidine-1-carbonyl)-4-(neopentylcarbamoyl)phenyl]-4-methyl-benzamide Formula: C29H36FN3O4 MolecularWeight: 509.612243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1C2=C(C=C(C=C2)C(=O)NCC(C)(C)C)C(=O)N3CCC(CC3)O)C(=O)NC4CC4)F

Isomeric SMILES

CC1=C(C=C(C=C1C2=C(C=C(C=C2)C(=O)NCC(C)(C)C)C(=O)N3CCC(CC3)O)C(=O)NC4CC4)F

InChI

InChI=1S/C29H36FN3O4/c1-17-23(14-19(15-25(17)30)27(36)32-20-6-7-20)22-8-5-18(26(35)31-16-29(2,3)4)13-24(22)28(37)33-11-9-21(34)10-12-33/h5,8,13-15,20-21,34H,6-7,9-12,16H2,1-4H3,(H,31,35)(H,32,36)