[(3aR,5S,6R,6aR)-6-azanyl-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]methyl benzoate

Systemtic Name: [(3aR,5S,6R,6aR)-6-azanyl-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]methyl benzoate Openeye Name: [(3aR,5S,6R,6aR)-6-amino-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]methyl benzoate CAS Name: benzoic acid [(3aR,5S,6R,6aR)-6-amino-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]methyl ester IUPAC Name: [(3aR,5S,6R,6aR)-6-amino-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]methyl benzoate Traditional Name: benzoic acid [(3aR,5S,6R,6aR)-6-amino-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]methyl ester Formula: C15H19NO5 MolecularWeight: 293.31506

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC2C(C(OC2O1)COC(=O)C3=CC=CC=C3)N)C

Isomeric SMILES

CC1(O[C@@H]2[C@@H]([C@H](O[C@@H]2O1)COC(=O)C3=CC=CC=C3)N)C

InChI

InChI=1S/C15H19NO5/c1-15(2)20-12-11(16)10(19-14(12)21-15)8-18-13(17)9-6-4-3-5-7-9/h3-7,10-12,14H,8,16H2,1-2H3/t10-,11-,12-,14-/m1/s1