S-[(3R,6S)-3-nitrooxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] propanethioate

Systemtic Name: S-[(3R,6S)-3-nitrooxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] propanethioate Openeye Name: S-[(3R,6S)-3-nitrooxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] propanethioate CAS Name: propanethioic acid S-[(3R,6S)-3-nitrooxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] ester IUPAC Name: S-[(3R,6S)-3-nitrooxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] propanethioate Traditional Name: propanethioic acid S-[(3R,6S)-3-nitrooxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] ester Formula: C9H13NO6S MolecularWeight: 263.26762

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)SC1COC2C1OCC2O[N+](=O)[O-]

Isomeric SMILES

CCC(=O)S[C@H]1COC2C1OC[C@H]2O[N+](=O)[O-]

InChI

InChI=1S/C9H13NO6S/c1-2-7(11)17-6-4-15-8-5(16-10(12)13)3-14-9(6)8/h5-6,8-9H,2-4H2,1H3/t5-,6+,8?,9?/m1/s1