N-[2-tert-butyl-5-(4-cycloheptyl-3-oxidanyl-butyl)phenyl]-2-(9H-xanthen-9-yl)ethanamide

Systemtic Name: N-[2-tert-butyl-5-(4-cycloheptyl-3-oxidanyl-butyl)phenyl]-2-(9H-xanthen-9-yl)ethanamide Openeye Name: N-[2-tert-butyl-5-(4-cycloheptyl-3-hydroxy-butyl)phenyl]-2-(9H-xanthen-9-yl)acetamide CAS Name: N-[2-tert-butyl-5-(4-cycloheptyl-3-hydroxybutyl)phenyl]-2-(9H-xanthen-9-yl)acetamide IUPAC Name: N-[2-tert-butyl-5-(4-cycloheptyl-3-hydroxybutyl)phenyl]-2-(9H-xanthen-9-yl)acetamide Traditional Name: N-[2-tert-butyl-5-(4-cycloheptyl-3-hydroxy-butyl)phenyl]-2-(9H-xanthen-9-yl)acetamide Formula: C36H45NO3 MolecularWeight: 539.7474

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=C(C=C1)CCC(CC2CCCCCC2)O)NC(=O)CC3C4=CC=CC=C4OC5=CC=CC=C35

Isomeric SMILES

CC(C)(C)C1=C(C=C(C=C1)CCC(CC2CCCCCC2)O)NC(=O)CC3C4=CC=CC=C4OC5=CC=CC=C35

InChI

InChI=1S/C36H45NO3/c1-36(2,3)31-21-19-26(18-20-27(38)22-25-12-6-4-5-7-13-25)23-32(31)37-35(39)24-30-28-14-8-10-16-33(28)40-34-17-11-9-15-29(30)34/h8-11,14-17,19,21,23,25,27,30,38H,4-7,12-13,18,20,22,24H2,1-3H3,(H,37,39)