(1S,3S)-3-oxidanyl-1-(phenylsulfonyl)cycloheptane-1-carbonitrile

Systemtic Name: (1S,3S)-3-oxidanyl-1-(phenylsulfonyl)cycloheptane-1-carbonitrile Openeye Name: (1S,3S)-1-(benzenesulfonyl)-3-hydroxy-cycloheptanecarbonitrile CAS Name: (1S,3S)-1-(benzenesulfonyl)-3-hydroxy-1-cycloheptanecarbonitrile IUPAC Name: (1S,3S)-1-(benzenesulfonyl)-3-hydroxycycloheptane-1-carbonitrile Traditional Name: (1S,3S)-1-besyl-3-hydroxy-cycloheptanecarbonitrile Formula: C14H17NO3S MolecularWeight: 279.35468

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC(C1)O)(C#N)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

C1CC[C@](C[C@H](C1)O)(C#N)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C14H17NO3S/c15-11-14(9-5-4-6-12(16)10-14)19(17,18)13-7-2-1-3-8-13/h1-3,7-8,12,16H,4-6,9-10H2/t12-,14-/m0/s1