2-[3-azanyl-2-(ethylaminooxysulfonyl)-6-nitro-phenyl]benzenesulfonic acid

Systemtic Name: 2-[3-azanyl-2-(ethylaminooxysulfonyl)-6-nitro-phenyl]benzenesulfonic acid Openeye Name: 2-[3-amino-2-(ethylaminooxysulfonyl)-6-nitro-phenyl]benzenesulfonic acid CAS Name: 2-[3-amino-2-(ethylaminooxysulfonyl)-6-nitrophenyl]benzenesulfonic acid IUPAC Name: 2-[3-amino-2-(ethylaminooxysulfonyl)-6-nitrophenyl]benzenesulfonic acid Traditional Name: 2-[3-amino-2-(ethylaminooxysulfonyl)-6-nitro-phenyl]besylic acid Formula: C14H15N3O8S2 MolecularWeight: 417.4142

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Descriptors Computed from Structure

Canonical SMILES:

CCNOS(=O)(=O)C1=C(C=CC(=C1C2=CC=CC=C2S(=O)(=O)O)[N+](=O)[O-])N

Isomeric SMILES

CCNOS(=O)(=O)C1=C(C=CC(=C1C2=CC=CC=C2S(=O)(=O)O)[N+](=O)[O-])N

InChI

InChI=1S/C14H15N3O8S2/c1-2-16-25-27(23,24)14-10(15)7-8-11(17(18)19)13(14)9-5-3-4-6-12(9)26(20,21)22/h3-8,16H,2,15H2,1H3,(H,20,21,22)