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

Systemtic Name: [(7R)-4-oxidanidyl-7-oxidanyl-5,6,7,8-tetrahydro-3H-pyrrolizin-4-ium-1-yl]methyl benzoate Openeye Name: [(7R)-7-hydroxy-4-oxido-5,6,7,8-tetrahydro-3H-pyrrolizin-4-ium-1-yl]methyl benzoate CAS Name: benzoic 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 benzoate Traditional Name: benzoic acid [(7R)-7-hydroxy-4-oxido-5,6,7,8-tetrahydro-3H-pyrrolizin-4-ium-1-yl]methyl ester Formula: C15H17NO4 MolecularWeight: 275.29978

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17NO4/c17-13-7-9-16(19)8-6-12(14(13)16)10-20-15(18)11-4-2-1-3-5-11/h1-6,13-14,17H,7-10H2/t13-,14?,16?/m1/s1