3-nitro-8,9,10,11-tetrahydro-7H-azepino[1,2-a]quinazolin-5-one

Systemtic Name: 3-nitro-8,9,10,11-tetrahydro-7H-azepino[1,2-a]quinazolin-5-one Openeye Name: 3-nitro-8,9,10,11-tetrahydro-7H-azepino[1,2-a]quinazolin-5-one CAS Name: 3-nitro-8,9,10,11-tetrahydro-7H-azepino[1,2-a]quinazolin-5-one IUPAC Name: 3-nitro-8,9,10,11-tetrahydro-7H-azepino[1,2-a]quinazolin-5-one Traditional Name: 3-nitro-8,9,10,11-tetrahydro-7H-azepino[1,2-a]quinazolin-5-one Formula: C13H13N3O3 MolecularWeight: 259.26062

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=NC(=O)C3=C(N2CC1)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCC2=NC(=O)C3=C(N2CC1)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C13H13N3O3/c17-13-10-8-9(16(18)19)5-6-11(10)15-7-3-1-2-4-12(15)14-13/h5-6,8H,1-4,7H2