sodium 2-propan-2-yloxy-4-(quinoxalin-6-ylcarbonylcarbamoylamino)benzoate

Systemtic Name: sodium 2-propan-2-yloxy-4-(quinoxalin-6-ylcarbonylcarbamoylamino)benzoate Openeye Name: sodium 2-isopropoxy-4-(quinoxaline-6-carbonylcarbamoylamino)benzoate CAS Name: sodium 4-[[oxo-[[oxo(6-quinoxalinyl)methyl]amino]methyl]amino]-2-propan-2-yloxybenzoate IUPAC Name: sodium 2-propan-2-yloxy-4-(quinoxaline-6-carbonylcarbamoylamino)benzoate Traditional Name: sodium 2-isopropoxy-4-(quinoxaline-6-carbonylcarbamoylamino)benzoate Formula: C20H17N4NaO5 MolecularWeight: 416.36255

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=CC(=C1)NC(=O)NC(=O)C2=CC3=NC=CN=C3C=C2)C(=O)[O-].[Na+]

Isomeric SMILES

CC(C)OC1=C(C=CC(=C1)NC(=O)NC(=O)C2=CC3=NC=CN=C3C=C2)C(=O)[O-].[Na+]

InChI

InChI=1S/C20H18N4O5.Na/c1-11(2)29-17-10-13(4-5-14(17)19(26)27)23-20(28)24-18(25)12-3-6-15-16(9-12)22-8-7-21-15;/h3-11H,1-2H3,(H,26,27)(H2,23,24,25,28);/q;+1/p-1