3-acetamido-2-nitro-benzoic acid; bicyclo[3.1.0]hexa-1(6),2,4-triene

Systemtic Name: 3-acetamido-2-nitro-benzoic acid; bicyclo[3.1.0]hexa-1(6),2,4-triene Openeye Name: 3-acetamido-2-nitro-benzoic acid; bicyclo[3.1.0]hexa-1(6),2,4-triene CAS Name: 3-acetamido-2-nitrobenzoic acid; bicyclo[3.1.0]hexa-1(6),2,4-triene IUPAC Name: 3-acetamido-2-nitrobenzoic acid; bicyclo[3.1.0]hexa-1(6),2,4-triene Traditional Name: 3-acetamido-2-nitro-benzoic acid; bicyclo[3.1.0]hexa-1(6),2,4-triene Formula: C15H12N2O5 MolecularWeight: 300.26618

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1[N+](=O)[O-])C(=O)O.C1=CC2=CC2=C1

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1[N+](=O)[O-])C(=O)O.C1=CC2=CC2=C1

InChI

InChI=1S/C9H8N2O5.C6H4/c1-5(12)10-7-4-2-3-6(9(13)14)8(7)11(15)16;1-2-5-4-6(5)3-1/h2-4H,1H3,(H,10,12)(H,13,14);1-4H