[(1R)-1-cyanoethyl] 4-azanyl-3-nitro-benzoate

Systemtic Name: [(1R)-1-cyanoethyl] 4-azanyl-3-nitro-benzoate Openeye Name: [(1R)-1-cyanoethyl] 4-amino-3-nitro-benzoate CAS Name: 4-amino-3-nitrobenzoic acid [(1R)-1-cyanoethyl] ester IUPAC Name: [(1R)-1-cyanoethyl] 4-amino-3-nitrobenzoate Traditional Name: 4-amino-3-nitro-benzoic acid [(1R)-1-cyanoethyl] ester Formula: C10H9N3O4 MolecularWeight: 235.19616

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)OC(=O)C1=CC(=C(C=C1)N)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C#N)OC(=O)C1=CC(=C(C=C1)N)[N+](=O)[O-]

InChI

InChI=1S/C10H9N3O4/c1-6(5-11)17-10(14)7-2-3-8(12)9(4-7)13(15)16/h2-4,6H,12H2,1H3/t6-/m1/s1