3-fluoranyl-7-nitro-5-pyridin-3-yl-1,3-dihydro-1,4-benzodiazepin-2-one

Systemtic Name: 3-fluoranyl-7-nitro-5-pyridin-3-yl-1,3-dihydro-1,4-benzodiazepin-2-one Openeye Name: 3-fluoro-7-nitro-5-(3-pyridyl)-1,3-dihydro-1,4-benzodiazepin-2-one CAS Name: 3-fluoro-7-nitro-5-(3-pyridinyl)-1,3-dihydro-1,4-benzodiazepin-2-one IUPAC Name: 3-fluoro-7-nitro-5-pyridin-3-yl-1,3-dihydro-1,4-benzodiazepin-2-one Traditional Name: 3-fluoro-7-nitro-5-(3-pyridyl)-1,3-dihydro-1,4-benzodiazepin-2-one Formula: C14H9FN4O3 MolecularWeight: 300.244663

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C2=NC(C(=O)NC3=C2C=C(C=C3)[N+](=O)[O-])F

Isomeric SMILES

C1=CC(=CN=C1)C2=NC(C(=O)NC3=C2C=C(C=C3)[N+](=O)[O-])F

InChI

InChI=1S/C14H9FN4O3/c15-13-14(20)17-11-4-3-9(19(21)22)6-10(11)12(18-13)8-2-1-5-16-7-8/h1-7,13H,(H,17,20)