4-[[7-chloranyl-3-oxidanyl-2,4-bis(oxidanylidene)-1H-quinazolin-6-yl]carbamoyl]benzoic acid

Systemtic Name: 4-[[7-chloranyl-3-oxidanyl-2,4-bis(oxidanylidene)-1H-quinazolin-6-yl]carbamoyl]benzoic acid Openeye Name: 4-[(7-chloro-3-hydroxy-2,4-dioxo-1H-quinazolin-6-yl)carbamoyl]benzoic acid CAS Name: 4-[[(7-chloro-3-hydroxy-2,4-dioxo-1H-quinazolin-6-yl)amino]-oxomethyl]benzoic acid IUPAC Name: 4-[(7-chloro-3-hydroxy-2,4-dioxo-1H-quinazolin-6-yl)carbamoyl]benzoic acid Traditional Name: 4-[(7-chloro-3-hydroxy-2,4-diketo-1H-quinazolin-6-yl)carbamoyl]benzoic acid Formula: C16H10ClN3O6 MolecularWeight: 375.7201

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC2=C(C=C3C(=C2)C(=O)N(C(=O)N3)O)Cl)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC2=C(C=C3C(=C2)C(=O)N(C(=O)N3)O)Cl)C(=O)O

InChI

InChI=1S/C16H10ClN3O6/c17-10-6-11-9(14(22)20(26)16(25)19-11)5-12(10)18-13(21)7-1-3-8(4-2-7)15(23)24/h1-6,26H,(H,18,21)(H,19,25)(H,23,24)