2-nitro-12-oxidanylidene-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-6-carbaldehyde

Systemtic Name: 2-nitro-12-oxidanylidene-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-6-carbaldehyde Openeye Name: 2-nitro-12-oxo-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-6-carbaldehyde CAS Name: 2-nitro-12-oxo-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-6-carboxaldehyde IUPAC Name: 2-nitro-12-oxo-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-6-carbaldehyde Traditional Name: 12-keto-2-nitro-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-6-carbaldehyde Formula: C14H13N3O4 MolecularWeight: 287.27072

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN2C(=NC3=C(C2=O)C=C(C=C3)[N+](=O)[O-])C(C1)C=O

Isomeric SMILES

C1CCN2C(=NC3=C(C2=O)C=C(C=C3)[N+](=O)[O-])C(C1)C=O

InChI

InChI=1S/C14H13N3O4/c18-8-9-3-1-2-6-16-13(9)15-12-5-4-10(17(20)21)7-11(12)14(16)19/h4-5,7-9H,1-3,6H2