(3R,4S)-4-butyl-2-oxidanylidene-5-phenethyl-oxolane-3-carbonitrile

Systemtic Name: (3R,4S)-4-butyl-2-oxidanylidene-5-phenethyl-oxolane-3-carbonitrile Openeye Name: (3R,4S)-4-butyl-2-oxo-5-phenethyl-tetrahydrofuran-3-carbonitrile CAS Name: (3R,4S)-4-butyl-2-oxo-5-phenethyl-3-oxolanecarbonitrile IUPAC Name: (3R,4S)-4-butyl-2-oxo-5-phenethyloxolane-3-carbonitrile Traditional Name: (3R,4S)-4-butyl-2-keto-5-phenethyl-tetrahydrofuran-3-carbonitrile Formula: C17H21NO2 MolecularWeight: 271.35414

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C(OC(=O)C1C#N)CCC2=CC=CC=C2

Isomeric SMILES

CCCC[C@H]1[C@@H](C(=O)OC1CCC2=CC=CC=C2)C#N

InChI

InChI=1S/C17H21NO2/c1-2-3-9-14-15(12-18)17(19)20-16(14)11-10-13-7-5-4-6-8-13/h4-8,14-16H,2-3,9-11H2,1H3/t14-,15-,16?/m0/s1