9-chloranyl-1-(hydroxymethyl)-7-phenyl-5H-pyrimido[1,2-a][1,4]benzodiazepin-3-one

Systemtic Name: 9-chloranyl-1-(hydroxymethyl)-7-phenyl-5H-pyrimido[1,2-a][1,4]benzodiazepin-3-one Openeye Name: 9-chloro-1-(hydroxymethyl)-7-phenyl-5H-pyrimido[1,2-a][1,4]benzodiazepin-3-one CAS Name: 9-chloro-1-(hydroxymethyl)-7-phenyl-5H-pyrimido[1,2-a][1,4]benzodiazepin-3-one IUPAC Name: 9-chloro-1-(hydroxymethyl)-7-phenyl-5H-pyrimido[1,2-a][1,4]benzodiazepin-3-one Traditional Name: 9-chloro-1-methylol-7-phenyl-5H-pyrimido[1,2-a][1,4]benzodiazepin-3-one Formula: C19H14ClN3O2 MolecularWeight: 351.78636

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=NC(=O)C=C(N2C3=C(C=C(C=C3)Cl)C(=N1)C4=CC=CC=C4)CO

Isomeric SMILES

C1C2=NC(=O)C=C(N2C3=C(C=C(C=C3)Cl)C(=N1)C4=CC=CC=C4)CO

InChI

InChI=1S/C19H14ClN3O2/c20-13-6-7-16-15(8-13)19(12-4-2-1-3-5-12)21-10-17-22-18(25)9-14(11-24)23(16)17/h1-9,24H,10-11H2