3-ethyl-2,4-bis(oxidanylidene)-1H-quinazoline-7-carboxylic acid hydrate

Systemtic Name: 3-ethyl-2,4-bis(oxidanylidene)-1H-quinazoline-7-carboxylic acid hydrate Openeye Name: 3-ethyl-2,4-dioxo-1H-quinazoline-7-carboxylic acid hydrate CAS Name: 3-ethyl-2,4-dioxo-1H-quinazoline-7-carboxylic acid hydrate IUPAC Name: 3-ethyl-2,4-dioxo-1H-quinazoline-7-carboxylic acid hydrate Traditional Name: 3-ethyl-2,4-diketo-1H-quinazoline-7-carboxylic acid hydrate Formula: C11H12N2O5 MolecularWeight: 252.22338

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C=C(C=C2)C(=O)O)NC1=O.O

Isomeric SMILES

CCN1C(=O)C2=C(C=C(C=C2)C(=O)O)NC1=O.O

InChI

InChI=1S/C11H10N2O4.H2O/c1-2-13-9(14)7-4-3-6(10(15)16)5-8(7)12-11(13)17;/h3-5H,2H2,1H3,(H,12,17)(H,15,16);1H2