chloranyl 3-oxidanyl-5-[(5-oxidanyl-1,4,5,6-tetrahydropyrimidin-2-yl)amino]benzoate

Systemtic Name: chloranyl 3-oxidanyl-5-[(5-oxidanyl-1,4,5,6-tetrahydropyrimidin-2-yl)amino]benzoate Openeye Name: chloro 3-hydroxy-5-[(5-hydroxy-1,4,5,6-tetrahydropyrimidin-2-yl)amino]benzoate CAS Name: 3-hydroxy-5-[(5-hydroxy-1,4,5,6-tetrahydropyrimidin-2-yl)amino]benzoic acid chloro ester IUPAC Name: chloro 3-hydroxy-5-[(5-hydroxy-1,4,5,6-tetrahydropyrimidin-2-yl)amino]benzoate Traditional Name: 3-hydroxy-5-[(5-hydroxy-1,4,5,6-tetrahydropyrimidin-2-yl)amino]benzoic acid chloro ester Formula: C11H12ClN3O4 MolecularWeight: 285.68368

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN=C(N1)NC2=CC(=CC(=C2)C(=O)OCl)O)O

Isomeric SMILES

C1C(CN=C(N1)NC2=CC(=CC(=C2)C(=O)OCl)O)O

InChI

InChI=1S/C11H12ClN3O4/c12-19-10(18)6-1-7(3-8(16)2-6)15-11-13-4-9(17)5-14-11/h1-3,9,16-17H,4-5H2,(H2,13,14,15)