4-(1,4-dioxa-8-azoniaspiro[4.5]decan-8-ylmethyl)-2-oxidanylidene-7-phenyl-chromen-6-olate

Systemtic Name: 4-(1,4-dioxa-8-azoniaspiro[4.5]decan-8-ylmethyl)-2-oxidanylidene-7-phenyl-chromen-6-olate Openeye Name: 4-(1,4-dioxa-8-azoniaspiro[4.5]decan-8-ylmethyl)-2-oxo-7-phenyl-chromen-6-olate CAS Name: 4-(1,4-dioxa-8-azoniaspiro[4.5]decan-8-ylmethyl)-2-oxo-7-phenyl-1-benzopyran-6-olate IUPAC Name: 4-(1,4-dioxa-8-azoniaspiro[4.5]decan-8-ylmethyl)-2-oxo-7-phenylchromen-6-olate Traditional Name: 4-(1,4-dioxa-8-azoniaspiro[4.5]decan-8-ylmethyl)-2-keto-7-phenyl-chromen-6-olate Formula: C23H23NO5 MolecularWeight: 393.43242

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC12OCCO2)CC3=CC(=O)OC4=CC(=C(C=C34)[O-])C5=CC=CC=C5

Isomeric SMILES

C1C[NH+](CCC12OCCO2)CC3=CC(=O)OC4=CC(=C(C=C34)[O-])C5=CC=CC=C5

InChI

InChI=1S/C23H23NO5/c25-20-13-19-17(15-24-8-6-23(7-9-24)27-10-11-28-23)12-22(26)29-21(19)14-18(20)16-4-2-1-3-5-16/h1-5,12-14,25H,6-11,15H2