(8-nitro-1-oxidanylidene-2,3,4,5-tetrahydro-2-benzazepin-4-yl) ethanoate

Systemtic Name: (8-nitro-1-oxidanylidene-2,3,4,5-tetrahydro-2-benzazepin-4-yl) ethanoate Openeye Name: (8-nitro-1-oxo-2,3,4,5-tetrahydro-2-benzazepin-4-yl) acetate CAS Name: acetic acid (8-nitro-1-oxo-2,3,4,5-tetrahydro-2-benzazepin-4-yl) ester IUPAC Name: (8-nitro-1-oxo-2,3,4,5-tetrahydro-2-benzazepin-4-yl) acetate Traditional Name: acetic acid (1-keto-8-nitro-2,3,4,5-tetrahydro-2-benzazepin-4-yl) ester Formula: C12H12N2O5 MolecularWeight: 264.23408

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC1

Isomeric SMILES

CC(=O)OC1CC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC1

InChI

InChI=1S/C12H12N2O5/c1-7(15)19-10-4-8-2-3-9(14(17)18)5-11(8)12(16)13-6-10/h2-3,5,10H,4,6H2,1H3,(H,13,16)