N-[2-tert-butyl-5-[7-cyclohexyl-2-(hydroxymethyl)heptyl]phenyl]-2-(9H-xanthen-9-yl)ethanamide

Systemtic Name: N-[2-tert-butyl-5-[7-cyclohexyl-2-(hydroxymethyl)heptyl]phenyl]-2-(9H-xanthen-9-yl)ethanamide Openeye Name: N-[2-tert-butyl-5-[7-cyclohexyl-2-(hydroxymethyl)heptyl]phenyl]-2-(9H-xanthen-9-yl)acetamide CAS Name: N-[2-tert-butyl-5-[7-cyclohexyl-2-(hydroxymethyl)heptyl]phenyl]-2-(9H-xanthen-9-yl)acetamide IUPAC Name: N-[2-tert-butyl-5-[7-cyclohexyl-2-(hydroxymethyl)heptyl]phenyl]-2-(9H-xanthen-9-yl)acetamide Traditional Name: N-[2-tert-butyl-5-(7-cyclohexyl-2-methylol-heptyl)phenyl]-2-(9H-xanthen-9-yl)acetamide Formula: C39H51NO3 MolecularWeight: 581.82714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=C(C=C1)CC(CCCCCC2CCCCC2)CO)NC(=O)CC3C4=CC=CC=C4OC5=CC=CC=C35

Isomeric SMILES

CC(C)(C)C1=C(C=C(C=C1)CC(CCCCCC2CCCCC2)CO)NC(=O)CC3C4=CC=CC=C4OC5=CC=CC=C35

InChI

InChI=1S/C39H51NO3/c1-39(2,3)34-23-22-29(24-30(27-41)17-9-5-8-16-28-14-6-4-7-15-28)25-35(34)40-38(42)26-33-31-18-10-12-20-36(31)43-37-21-13-11-19-32(33)37/h10-13,18-23,25,28,30,33,41H,4-9,14-17,24,26-27H2,1-3H3,(H,40,42)