N-[2-tert-butyl-5-(5-cycloheptyl-3-oxidanyl-pentyl)phenyl]-2-(9H-xanthen-9-yl)ethanamide

Systemtic Name: N-[2-tert-butyl-5-(5-cycloheptyl-3-oxidanyl-pentyl)phenyl]-2-(9H-xanthen-9-yl)ethanamide Openeye Name: N-[2-tert-butyl-5-(5-cycloheptyl-3-hydroxy-pentyl)phenyl]-2-(9H-xanthen-9-yl)acetamide CAS Name: N-[2-tert-butyl-5-(5-cycloheptyl-3-hydroxypentyl)phenyl]-2-(9H-xanthen-9-yl)acetamide IUPAC Name: N-[2-tert-butyl-5-(5-cycloheptyl-3-hydroxypentyl)phenyl]-2-(9H-xanthen-9-yl)acetamide Traditional Name: N-[2-tert-butyl-5-(5-cycloheptyl-3-hydroxy-pentyl)phenyl]-2-(9H-xanthen-9-yl)acetamide Formula: C37H47NO3 MolecularWeight: 553.77398

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=C(C=C1)CCC(CCC2CCCCCC2)O)NC(=O)CC3C4=CC=CC=C4OC5=CC=CC=C35

Isomeric SMILES

CC(C)(C)C1=C(C=C(C=C1)CCC(CCC2CCCCCC2)O)NC(=O)CC3C4=CC=CC=C4OC5=CC=CC=C35

InChI

InChI=1S/C37H47NO3/c1-37(2,3)32-23-20-27(19-22-28(39)21-18-26-12-6-4-5-7-13-26)24-33(32)38-36(40)25-31-29-14-8-10-16-34(29)41-35-17-11-9-15-30(31)35/h8-11,14-17,20,23-24,26,28,31,39H,4-7,12-13,18-19,21-22,25H2,1-3H3,(H,38,40)