azanium 2-(5,6-dimethyl-9-oxidanylidene-xanthen-4-yl)ethanoate

Systemtic Name: azanium 2-(5,6-dimethyl-9-oxidanylidene-xanthen-4-yl)ethanoate Openeye Name: ammonium 2-(5,6-dimethyl-9-oxo-xanthen-4-yl)acetate CAS Name: ammonium 2-(5,6-dimethyl-9-oxo-4-xanthenyl)acetate IUPAC Name: azanium 2-(5,6-dimethyl-9-oxoxanthen-4-yl)acetate Traditional Name: ammonium 2-(9-keto-5,6-dimethyl-xanthen-4-yl)acetate Formula: C17H17NO4 MolecularWeight: 299.32118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=O)C3=C(O2)C(=CC=C3)CC(=O)[O-])C.[NH4+]

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=O)C3=C(O2)C(=CC=C3)CC(=O)[O-])C.[NH4+]

InChI

InChI=1S/C17H14O4.H3N/c1-9-6-7-13-15(20)12-5-3-4-11(8-14(18)19)17(12)21-16(13)10(9)2;/h3-7H,8H2,1-2H3,(H,18,19);1H3