4-oxidanylidene-4-(9H-xanthen-9-ylamino)butanoic acid; sodium

Systemtic Name: 4-oxidanylidene-4-(9H-xanthen-9-ylamino)butanoic acid; sodium Openeye Name: 4-oxo-4-(9H-xanthen-9-ylamino)butanoic acid; sodium CAS Name: 4-oxo-4-(9H-xanthen-9-ylamino)butanoic acid; sodium IUPAC Name: 4-oxo-4-(9H-xanthen-9-ylamino)butanoic acid; sodium Traditional Name: 4-keto-4-(9H-xanthen-9-ylamino)butyric acid; sodium Formula: C17H15NNaO4 MolecularWeight: 320.29507

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C3=CC=CC=C3O2)NC(=O)CCC(=O)O.[Na]

Isomeric SMILES

C1=CC=C2C(=C1)C(C3=CC=CC=C3O2)NC(=O)CCC(=O)O.[Na]

InChI

InChI=1S/C17H15NO4.Na/c19-15(9-10-16(20)21)18-17-11-5-1-3-7-13(11)22-14-8-4-2-6-12(14)17;/h1-8,17H,9-10H2,(H,18,19)(H,20,21);