N-(4-azanyl-1-cyclohexyl-3-oxidanyl-butan-2-yl)-3-[1-(3-chloranyl-2-fluoranyl-phenyl)-5-methoxy-1-oxidanyl-pentyl]piperidine-1-carboxamide

Systemtic Name: N-(4-azanyl-1-cyclohexyl-3-oxidanyl-butan-2-yl)-3-[1-(3-chloranyl-2-fluoranyl-phenyl)-5-methoxy-1-oxidanyl-pentyl]piperidine-1-carboxamide Openeye Name: N-[3-amino-1-(cyclohexylmethyl)-2-hydroxy-propyl]-3-[1-(3-chloro-2-fluoro-phenyl)-1-hydroxy-5-methoxy-pentyl]piperidine-1-carboxamide CAS Name: N-(4-amino-1-cyclohexyl-3-hydroxybutan-2-yl)-3-[1-(3-chloro-2-fluorophenyl)-1-hydroxy-5-methoxypentyl]-1-piperidinecarboxamide IUPAC Name: N-(4-amino-1-cyclohexyl-3-hydroxybutan-2-yl)-3-[1-(3-chloro-2-fluorophenyl)-1-hydroxy-5-methoxypentyl]piperidine-1-carboxamide Traditional Name: N-[3-amino-1-(cyclohexylmethyl)-2-hydroxy-propyl]-3-[1-(3-chloro-2-fluoro-phenyl)-1-hydroxy-5-methoxy-pentyl]piperidine-1-carboxamide Formula: C28H45ClFN3O4 MolecularWeight: 542.126003

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Descriptors Computed from Structure

Canonical SMILES:

COCCCCC(C1CCCN(C1)C(=O)NC(CC2CCCCC2)C(CN)O)(C3=C(C(=CC=C3)Cl)F)O

Isomeric SMILES

COCCCCC(C1CCCN(C1)C(=O)NC(CC2CCCCC2)C(CN)O)(C3=C(C(=CC=C3)Cl)F)O

InChI

InChI=1S/C28H45ClFN3O4/c1-37-16-6-5-14-28(36,22-12-7-13-23(29)26(22)30)21-11-8-15-33(19-21)27(35)32-24(25(34)18-31)17-20-9-3-2-4-10-20/h7,12-13,20-21,24-25,34,36H,2-6,8-11,14-19,31H2,1H3,(H,32,35)