2-[3-(7-cycloheptyl-5-oxidanyl-heptyl)phenyl]-3,3-dimethyl-2-(9H-xanthen-9-yl)butanamide

Systemtic Name: 2-[3-(7-cycloheptyl-5-oxidanyl-heptyl)phenyl]-3,3-dimethyl-2-(9H-xanthen-9-yl)butanamide Openeye Name: 2-[3-(7-cycloheptyl-5-hydroxy-heptyl)phenyl]-3,3-dimethyl-2-(9H-xanthen-9-yl)butanamide CAS Name: 2-[3-(7-cycloheptyl-5-hydroxyheptyl)phenyl]-3,3-dimethyl-2-(9H-xanthen-9-yl)butanamide IUPAC Name: 2-[3-(7-cycloheptyl-5-hydroxyheptyl)phenyl]-3,3-dimethyl-2-(9H-xanthen-9-yl)butanamide Traditional Name: 2-[3-(7-cycloheptyl-5-hydroxy-heptyl)phenyl]-3,3-dimethyl-2-(9H-xanthen-9-yl)butyramide Formula: C39H51NO3 MolecularWeight: 581.82714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C1C2=CC=CC=C2OC3=CC=CC=C13)(C4=CC=CC(=C4)CCCCC(CCC5CCCCCC5)O)C(=O)N

Isomeric SMILES

CC(C)(C)C(C1C2=CC=CC=C2OC3=CC=CC=C13)(C4=CC=CC(=C4)CCCCC(CCC5CCCCCC5)O)C(=O)N

InChI

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