3,3-dimethyl-1-[(2S)-2-(3-phenylpropoxymethyl)-3-azabicyclo[2.2.1]heptan-3-yl]pentane-1,2-dione

Systemtic Name: 3,3-dimethyl-1-[(2S)-2-(3-phenylpropoxymethyl)-3-azabicyclo[2.2.1]heptan-3-yl]pentane-1,2-dione Openeye Name: 3,3-dimethyl-1-[(2S)-2-(3-phenylpropoxymethyl)-3-azabicyclo[2.2.1]heptan-3-yl]pentane-1,2-dione CAS Name: 3,3-dimethyl-1-[(2S)-2-(3-phenylpropoxymethyl)-3-azabicyclo[2.2.1]heptan-3-yl]pentane-1,2-dione IUPAC Name: 3,3-dimethyl-1-[(2S)-2-(3-phenylpropoxymethyl)-3-azabicyclo[2.2.1]heptan-3-yl]pentane-1,2-dione Traditional Name: 3,3-dimethyl-1-[(2S)-2-(3-phenylpropoxymethyl)-3-azabicyclo[2.2.1]heptan-3-yl]pentane-1,2-dione Formula: C23H33NO3 MolecularWeight: 371.51302

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C(=O)C(=O)N1C2CCC(C2)C1COCCCC3=CC=CC=C3

Isomeric SMILES

CCC(C)(C)C(=O)C(=O)N1[C@@H](C2CCC1C2)COCCCC3=CC=CC=C3

InChI

InChI=1S/C23H33NO3/c1-4-23(2,3)21(25)22(26)24-19-13-12-18(15-19)20(24)16-27-14-8-11-17-9-6-5-7-10-17/h5-7,9-10,18-20H,4,8,11-16H2,1-3H3/t18?,19?,20-/m1/s1