2-benzamidoethyl 3-nitro-4-oxidanyl-benzoate

Systemtic Name: 2-benzamidoethyl 3-nitro-4-oxidanyl-benzoate Openeye Name: 2-benzamidoethyl 4-hydroxy-3-nitro-benzoate CAS Name: 4-hydroxy-3-nitrobenzoic acid 2-benzamidoethyl ester IUPAC Name: 2-benzamidoethyl 4-hydroxy-3-nitrobenzoate Traditional Name: 4-hydroxy-3-nitro-benzoic acid 2-benzamidoethyl ester Formula: C16H14N2O6 MolecularWeight: 330.29216

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14N2O6/c19-14-7-6-12(10-13(14)18(22)23)16(21)24-9-8-17-15(20)11-4-2-1-3-5-11/h1-7,10,19H,8-9H2,(H,17,20)