2-[4-(1,4-dioxa-8-azoniaspiro[4.5]decan-8-ylmethyl)phenyl]ethanoate

Systemtic Name: 2-[4-(1,4-dioxa-8-azoniaspiro[4.5]decan-8-ylmethyl)phenyl]ethanoate Openeye Name: 2-[4-(1,4-dioxa-8-azoniaspiro[4.5]decan-8-ylmethyl)phenyl]acetate CAS Name: 2-[4-(1,4-dioxa-8-azoniaspiro[4.5]decan-8-ylmethyl)phenyl]acetate IUPAC Name: 2-[4-(1,4-dioxa-8-azoniaspiro[4.5]decan-8-ylmethyl)phenyl]acetate Traditional Name: 2-[4-(1,4-dioxa-8-azoniaspiro[4.5]decan-8-ylmethyl)phenyl]acetate Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21NO4/c18-15(19)11-13-1-3-14(4-2-13)12-17-7-5-16(6-8-17)20-9-10-21-16/h1-4H,5-12H2,(H,18,19)