sodium; 2-methyl-1H-quinazolin-4-one; phenylbenzene

Systemtic Name: sodium; 2-methyl-1H-quinazolin-4-one; phenylbenzene Openeye Name: sodium; 2-methyl-1H-quinazolin-4-one; phenylbenzene CAS Name: sodium; 2-methyl-1H-quinazolin-4-one; phenylbenzene IUPAC Name: sodium; 2-methyl-1H-quinazolin-4-one; phenylbenzene Traditional Name: sodium; 2-methyl-1H-quinazolin-4-one; phenylbenzene Formula: C21H17N2NaO MolecularWeight: 336.36225

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)C2=CC=CC=C2N1.C1=CC=C(C=C1)C2=CC=[C-]C=C2.[Na+]

Isomeric SMILES

CC1=NC(=O)C2=CC=CC=C2N1.C1=CC=C(C=C1)C2=CC=[C-]C=C2.[Na+]

InChI

InChI=1S/C12H9.C9H8N2O.Na/c1-3-7-11(8-4-1)12-9-5-2-6-10-12;1-6-10-8-5-3-2-4-7(8)9(12)11-6;/h1,3-10H;2-5H,1H3,(H,10,11,12);/q-1;;+1