2-[3-[3-bis(phenylmethyl)phosphoryl-3-phenyl-propanoyl]-2,2-dimethyl-cyclobutyl]ethanenitrile

Systemtic Name: 2-[3-[3-bis(phenylmethyl)phosphoryl-3-phenyl-propanoyl]-2,2-dimethyl-cyclobutyl]ethanenitrile Openeye Name: 2-[3-(3-dibenzylphosphoryl-3-phenyl-propanoyl)-2,2-dimethyl-cyclobutyl]acetonitrile CAS Name: 2-[3-[3-bis(phenylmethyl)phosphoryl-1-oxo-3-phenylpropyl]-2,2-dimethylcyclobutyl]acetonitrile IUPAC Name: 2-[3-(3-dibenzylphosphoryl-3-phenylpropanoyl)-2,2-dimethylcyclobutyl]acetonitrile Traditional Name: 2-[3-(3-dibenzylphosphoryl-3-phenyl-propanoyl)-2,2-dimethyl-cyclobutyl]acetonitrile Formula: C31H34NO2P MolecularWeight: 483.580921

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CC1C(=O)CC(C2=CC=CC=C2)P(=O)(CC3=CC=CC=C3)CC4=CC=CC=C4)CC#N)C

Isomeric SMILES

CC1(C(CC1C(=O)CC(C2=CC=CC=C2)P(=O)(CC3=CC=CC=C3)CC4=CC=CC=C4)CC#N)C

InChI

InChI=1S/C31H34NO2P/c1-31(2)27(18-19-32)20-28(31)29(33)21-30(26-16-10-5-11-17-26)35(34,22-24-12-6-3-7-13-24)23-25-14-8-4-9-15-25/h3-17,27-28,30H,18,20-23H2,1-2H3