[(7R)-4-oxidanidyl-7-oxidanyl-5,6,7,8-tetrahydro-3H-pyrrolizin-4-ium-1-yl]methyl 2-phenylethanoate

Systemtic Name: [(7R)-4-oxidanidyl-7-oxidanyl-5,6,7,8-tetrahydro-3H-pyrrolizin-4-ium-1-yl]methyl 2-phenylethanoate Openeye Name: [(7R)-7-hydroxy-4-oxido-5,6,7,8-tetrahydro-3H-pyrrolizin-4-ium-1-yl]methyl 2-phenylacetate CAS Name: 2-phenylacetic acid [(7R)-7-hydroxy-4-oxido-5,6,7,8-tetrahydro-3H-pyrrolizin-4-ium-1-yl]methyl ester IUPAC Name: [(7R)-7-hydroxy-4-oxido-5,6,7,8-tetrahydro-3H-pyrrolizin-4-ium-1-yl]methyl 2-phenylacetate Traditional Name: 2-phenylacetic acid [(7R)-7-hydroxy-4-oxido-5,6,7,8-tetrahydro-3H-pyrrolizin-4-ium-1-yl]methyl ester Formula: C16H19NO4 MolecularWeight: 289.32636

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+]2(CC=C(C2C1O)COC(=O)CC3=CC=CC=C3)[O-]

Isomeric SMILES

C1C[N+]2(CC=C(C2[C@@H]1O)COC(=O)CC3=CC=CC=C3)[O-]

InChI

InChI=1S/C16H19NO4/c18-14-7-9-17(20)8-6-13(16(14)17)11-21-15(19)10-12-4-2-1-3-5-12/h1-6,14,16,18H,7-11H2/t14-,16?,17?/m1/s1