2-[(1R,2R,3R,5S)-3,5-diethanoyl-2-(phenylmethoxymethyl)cyclopentyl]ethanenitrile

Systemtic Name: 2-[(1R,2R,3R,5S)-3,5-diethanoyl-2-(phenylmethoxymethyl)cyclopentyl]ethanenitrile Openeye Name: 2-[(1R,2R,3R,5S)-3,5-diacetyl-2-(benzyloxymethyl)cyclopentyl]acetonitrile CAS Name: 2-[(1R,2R,3R,5S)-3,5-diacetyl-2-(phenylmethoxymethyl)cyclopentyl]acetonitrile IUPAC Name: 2-[(1R,2R,3R,5S)-3,5-diacetyl-2-(phenylmethoxymethyl)cyclopentyl]acetonitrile Traditional Name: 2-[(1R,2R,3R,5S)-3,5-diacetyl-2-(benzoxymethyl)cyclopentyl]acetonitrile Formula: C19H23NO3 MolecularWeight: 313.39082

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1CC(C(C1CC#N)COCC2=CC=CC=C2)C(=O)C

Isomeric SMILES

CC(=O)[C@H]1C[C@H]([C@@H]([C@H]1CC#N)COCC2=CC=CC=C2)C(=O)C

InChI

InChI=1S/C19H23NO3/c1-13(21)17-10-18(14(2)22)19(16(17)8-9-20)12-23-11-15-6-4-3-5-7-15/h3-7,16-19H,8,10-12H2,1-2H3/t16-,17+,18-,19+/m0/s1