2-chloranyl-5-[1-(3-methoxy-2-oxidanyl-propyl)-5-methyl-pyrazol-3-yl]-N-[(1-oxidanylcycloheptyl)methyl]benzamide

Systemtic Name: 2-chloranyl-5-[1-(3-methoxy-2-oxidanyl-propyl)-5-methyl-pyrazol-3-yl]-N-[(1-oxidanylcycloheptyl)methyl]benzamide Openeye Name: 2-chloro-N-[(1-hydroxycycloheptyl)methyl]-5-[1-(2-hydroxy-3-methoxy-propyl)-5-methyl-pyrazol-3-yl]benzamide CAS Name: 2-chloro-N-[(1-hydroxycycloheptyl)methyl]-5-[1-(2-hydroxy-3-methoxypropyl)-5-methyl-3-pyrazolyl]benzamide IUPAC Name: 2-chloro-N-[(1-hydroxycycloheptyl)methyl]-5-[1-(2-hydroxy-3-methoxypropyl)-5-methylpyrazol-3-yl]benzamide Traditional Name: 2-chloro-N-[(1-hydroxycycloheptyl)methyl]-5-[1-(2-hydroxy-3-methoxy-propyl)-5-methyl-pyrazol-3-yl]benzamide Formula: C23H32ClN3O4 MolecularWeight: 449.97088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC(COC)O)C2=CC(=C(C=C2)Cl)C(=O)NCC3(CCCCCC3)O

Isomeric SMILES

CC1=CC(=NN1CC(COC)O)C2=CC(=C(C=C2)Cl)C(=O)NCC3(CCCCCC3)O

InChI

InChI=1S/C23H32ClN3O4/c1-16-11-21(26-27(16)13-18(28)14-31-2)17-7-8-20(24)19(12-17)22(29)25-15-23(30)9-5-3-4-6-10-23/h7-8,11-12,18,28,30H,3-6,9-10,13-15H2,1-2H3,(H,25,29)