2-methyl-1H-quinazolin-4-one hydrate

Systemtic Name: 2-methyl-1H-quinazolin-4-one hydrate Openeye Name: 2-methyl-1H-quinazolin-4-one hydrate CAS Name: 2-methyl-1H-quinazolin-4-one hydrate IUPAC Name: 2-methyl-1H-quinazolin-4-one hydrate Traditional Name: 2-methyl-1H-quinazolin-4-one hydrate Formula: C9H10N2O2 MolecularWeight: 178.1879

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)C2=CC=CC=C2N1.O

Isomeric SMILES

CC1=NC(=O)C2=CC=CC=C2N1.O

InChI

InChI=1S/C9H8N2O.H2O/c1-6-10-8-5-3-2-4-7(8)9(12)11-6;/h2-5H,1H3,(H,10,11,12);1H2