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sodium 4-(1,3-benzoxazol-6-ylcarbonylcarbamoylamino)benzoate

sodium 4-(1,3-benzoxazol-6-ylcarbonylcarbamoylamino)benzoate

Systemtic Name:sodium 4-(1,3-benzoxazol-6-ylcarbonylcarbamoylamino)benzoate
Openeye Name:sodium 4-(1,3-benzoxazole-6-carbonylcarbamoylamino)benzoate
CAS Name:sodium 4-[[[[1,3-benzoxazol-6-yl(oxo)methyl]amino]-oxomethyl]amino]benzoate
IUPAC Name:sodium 4-(1,3-benzoxazole-6-carbonylcarbamoylamino)benzoate
Traditional Name:sodium 4-(1,3-benzoxazole-6-carbonylcarbamoylamino)benzoate
Formula: C16H10N3NaO5
MolecularWeight: 347.25747
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)[O-])NC(=O)NC(=O)C2=CC3=C(C=C2)N=CO3.[Na+]


Isomeric SMILES

C1=CC(=CC=C1C(=O)[O-])NC(=O)NC(=O)C2=CC3=C(C=C2)N=CO3.[Na+]


InChI

InChI=1S/C16H11N3O5.Na/c20-14(10-3-6-12-13(7-10)24-8-17-12)19-16(23)18-11-4-1-9(2-5-11)15(21)22;/h1-8H,(H,21,22)(H2,18,19,20,23);/q;+1/p-1


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