N-[2-tert-butyl-5-[(E)-4-cyclohexyl-2-(phenylmethoxymethyl)but-1-enyl]phenyl]-2-(9H-xanthen-9-yl)ethanamide

Systemtic Name: N-[2-tert-butyl-5-[(E)-4-cyclohexyl-2-(phenylmethoxymethyl)but-1-enyl]phenyl]-2-(9H-xanthen-9-yl)ethanamide Openeye Name: N-[5-[(E)-2-(benzyloxymethyl)-4-cyclohexyl-but-1-enyl]-2-tert-butyl-phenyl]-2-(9H-xanthen-9-yl)acetamide CAS Name: N-[2-tert-butyl-5-[(E)-4-cyclohexyl-2-(phenylmethoxymethyl)but-1-enyl]phenyl]-2-(9H-xanthen-9-yl)acetamide IUPAC Name: N-[2-tert-butyl-5-[(E)-4-cyclohexyl-2-(phenylmethoxymethyl)but-1-enyl]phenyl]-2-(9H-xanthen-9-yl)acetamide Traditional Name: N-[5-[(E)-2-(benzoxymethyl)-4-cyclohexyl-but-1-enyl]-2-tert-butyl-phenyl]-2-(9H-xanthen-9-yl)acetamide Formula: C43H49NO3 MolecularWeight: 627.85406

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=C(C=C1)C=C(CCC2CCCCC2)COCC3=CC=CC=C3)NC(=O)CC4C5=CC=CC=C5OC6=CC=CC=C46

Isomeric SMILES

CC(C)(C)C1=C(C=C(C=C1)/C=C(\CCC2CCCCC2)/COCC3=CC=CC=C3)NC(=O)CC4C5=CC=CC=C5OC6=CC=CC=C46

InChI

InChI=1S/C43H49NO3/c1-43(2,3)38-25-24-33(26-34(23-22-31-14-6-4-7-15-31)30-46-29-32-16-8-5-9-17-32)27-39(38)44-42(45)28-37-35-18-10-12-20-40(35)47-41-21-13-11-19-36(37)41/h5,8-13,16-21,24-27,31,37H,4,6-7,14-15,22-23,28-30H2,1-3H3,(H,44,45)/b34-26+