3,3-dimethyl-2-[3-(3-oxidanyldodecyl)phenyl]-2-(9H-xanthen-9-yl)butanamide

Systemtic Name: 3,3-dimethyl-2-[3-(3-oxidanyldodecyl)phenyl]-2-(9H-xanthen-9-yl)butanamide Openeye Name: 2-[3-(3-hydroxydodecyl)phenyl]-3,3-dimethyl-2-(9H-xanthen-9-yl)butanamide CAS Name: 2-[3-(3-hydroxydodecyl)phenyl]-3,3-dimethyl-2-(9H-xanthen-9-yl)butanamide IUPAC Name: 2-[3-(3-hydroxydodecyl)phenyl]-3,3-dimethyl-2-(9H-xanthen-9-yl)butanamide Traditional Name: 2-[3-(3-hydroxydodecyl)phenyl]-3,3-dimethyl-2-(9H-xanthen-9-yl)butyramide Formula: C37H49NO3 MolecularWeight: 555.78986

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(CCC1=CC(=CC=C1)C(C2C3=CC=CC=C3OC4=CC=CC=C24)(C(=O)N)C(C)(C)C)O

Isomeric SMILES

CCCCCCCCCC(CCC1=CC(=CC=C1)C(C2C3=CC=CC=C3OC4=CC=CC=C24)(C(=O)N)C(C)(C)C)O

InChI

InChI=1S/C37H49NO3/c1-5-6-7-8-9-10-11-19-29(39)25-24-27-17-16-18-28(26-27)37(35(38)40,36(2,3)4)34-30-20-12-14-22-32(30)41-33-23-15-13-21-31(33)34/h12-18,20-23,26,29,34,39H,5-11,19,24-25H2,1-4H3,(H2,38,40)