ethyl 5-azanyl-2-(3-oxidanyl-6-oxidanylidene-xanthen-9-yl)benzoate

Systemtic Name: ethyl 5-azanyl-2-(3-oxidanyl-6-oxidanylidene-xanthen-9-yl)benzoate Openeye Name: ethyl 5-amino-2-(3-hydroxy-6-oxo-xanthen-9-yl)benzoate CAS Name: 5-amino-2-(3-hydroxy-6-oxo-9-xanthenyl)benzoic acid ethyl ester IUPAC Name: ethyl 5-amino-2-(3-hydroxy-6-oxoxanthen-9-yl)benzoate Traditional Name: 5-amino-2-(3-hydroxy-6-keto-xanthen-9-yl)benzoic acid ethyl ester Formula: C22H17NO5 MolecularWeight: 375.37408

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=CC(=C1)N)C2=C3C=CC(=O)C=C3OC4=C2C=CC(=C4)O

Isomeric SMILES

CCOC(=O)C1=C(C=CC(=C1)N)C2=C3C=CC(=O)C=C3OC4=C2C=CC(=C4)O

InChI

InChI=1S/C22H17NO5/c1-2-27-22(26)18-9-12(23)3-6-15(18)21-16-7-4-13(24)10-19(16)28-20-11-14(25)5-8-17(20)21/h3-11,24H,2,23H2,1H3