7-(2-chlorophenyl)-1-methyl-9-nitro-5H-pyrimido[1,2-a][1,4]benzodiazepin-3-one

Systemtic Name: 7-(2-chlorophenyl)-1-methyl-9-nitro-5H-pyrimido[1,2-a][1,4]benzodiazepin-3-one Openeye Name: 7-(2-chlorophenyl)-1-methyl-9-nitro-5H-pyrimido[1,2-a][1,4]benzodiazepin-3-one CAS Name: 7-(2-chlorophenyl)-1-methyl-9-nitro-5H-pyrimido[1,2-a][1,4]benzodiazepin-3-one IUPAC Name: 7-(2-chlorophenyl)-1-methyl-9-nitro-5H-pyrimido[1,2-a][1,4]benzodiazepin-3-one Traditional Name: 7-(2-chlorophenyl)-1-methyl-9-nitro-5H-pyrimido[1,2-a][1,4]benzodiazepin-3-one Formula: C19H13ClN4O3 MolecularWeight: 380.78452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C2N1C3=C(C=C(C=C3)[N+](=O)[O-])C(=NC2)C4=CC=CC=C4Cl

Isomeric SMILES

CC1=CC(=O)N=C2N1C3=C(C=C(C=C3)[N+](=O)[O-])C(=NC2)C4=CC=CC=C4Cl

InChI

InChI=1S/C19H13ClN4O3/c1-11-8-18(25)22-17-10-21-19(13-4-2-3-5-15(13)20)14-9-12(24(26)27)6-7-16(14)23(11)17/h2-9H,10H2,1H3