(phenylmethyl) 3-azanyl-4-nitro-benzoate

Systemtic Name: (phenylmethyl) 3-azanyl-4-nitro-benzoate Openeye Name: benzyl 3-amino-4-nitro-benzoate CAS Name: 3-amino-4-nitrobenzoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-amino-4-nitrobenzoate Traditional Name: 3-amino-4-nitro-benzoic acid benzyl ester Formula: C14H12N2O4 MolecularWeight: 272.25608

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C2=CC(=C(C=C2)[N+](=O)[O-])N

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C2=CC(=C(C=C2)[N+](=O)[O-])N

InChI

InChI=1S/C14H12N2O4/c15-12-8-11(6-7-13(12)16(18)19)14(17)20-9-10-4-2-1-3-5-10/h1-8H,9,15H2