3-(1,4-dioxa-8-azoniaspiro[4.5]decan-8-ylmethyl)benzoate

Systemtic Name: 3-(1,4-dioxa-8-azoniaspiro[4.5]decan-8-ylmethyl)benzoate Openeye Name: 3-(1,4-dioxa-8-azoniaspiro[4.5]decan-8-ylmethyl)benzoate CAS Name: 3-(1,4-dioxa-8-azoniaspiro[4.5]decan-8-ylmethyl)benzoate IUPAC Name: 3-(1,4-dioxa-8-azoniaspiro[4.5]decan-8-ylmethyl)benzoate Traditional Name: 3-(1,4-dioxa-8-azoniaspiro[4.5]decan-8-ylmethyl)benzoate Formula: C15H19NO4 MolecularWeight: 277.31566

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC12OCCO2)CC3=CC=CC(=C3)C(=O)[O-]

Isomeric SMILES

C1C[NH+](CCC12OCCO2)CC3=CC=CC(=C3)C(=O)[O-]

InChI

InChI=1S/C15H19NO4/c17-14(18)13-3-1-2-12(10-13)11-16-6-4-15(5-7-16)19-8-9-20-15/h1-3,10H,4-9,11H2,(H,17,18)