4-[[2-(5-chloranyl-2-oxidanyl-phenyl)-4-oxidanylidene-1,2-dihydroquinazolin-3-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[2-(5-chloranyl-2-oxidanyl-phenyl)-4-oxidanylidene-1,2-dihydroquinazolin-3-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[2-(5-chloro-2-hydroxy-phenyl)-4-oxo-1,2-dihydroquinazolin-3-yl]amino]-4-oxo-butanoic acid CAS Name: 4-[[2-(5-chloro-2-hydroxyphenyl)-4-oxo-1,2-dihydroquinazolin-3-yl]amino]-4-oxobutanoic acid IUPAC Name: 4-[[2-(5-chloro-2-hydroxyphenyl)-4-oxo-1,2-dihydroquinazolin-3-yl]amino]-4-oxobutanoic acid Traditional Name: 4-[[2-(5-chloro-2-hydroxy-phenyl)-4-keto-1,2-dihydroquinazolin-3-yl]amino]-4-keto-butyric acid Formula: C18H16ClN3O5 MolecularWeight: 389.78974

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(N2)C3=C(C=CC(=C3)Cl)O)NC(=O)CCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(N2)C3=C(C=CC(=C3)Cl)O)NC(=O)CCC(=O)O

InChI

InChI=1S/C18H16ClN3O5/c19-10-5-6-14(23)12(9-10)17-20-13-4-2-1-3-11(13)18(27)22(17)21-15(24)7-8-16(25)26/h1-6,9,17,20,23H,7-8H2,(H,21,24)(H,25,26)