2-[2-azanyl-6-(2-azanylpropyl)-3-nitro-phenyl]sulfonylethanesulfonic acid

Systemtic Name: 2-[2-azanyl-6-(2-azanylpropyl)-3-nitro-phenyl]sulfonylethanesulfonic acid Openeye Name: 2-[2-amino-6-(2-aminopropyl)-3-nitro-phenyl]sulfonylethanesulfonic acid CAS Name: 2-[2-amino-6-(2-aminopropyl)-3-nitrophenyl]sulfonylethanesulfonic acid IUPAC Name: 2-[2-amino-6-(2-aminopropyl)-3-nitrophenyl]sulfonylethanesulfonic acid Traditional Name: 2-[2-amino-6-(2-aminopropyl)-3-nitro-phenyl]sulfonylethanesulfonic acid Formula: C11H17N3O7S2 MolecularWeight: 367.39858

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=C(C(=C(C=C1)[N+](=O)[O-])N)S(=O)(=O)CCS(=O)(=O)O)N

Isomeric SMILES

CC(CC1=C(C(=C(C=C1)[N+](=O)[O-])N)S(=O)(=O)CCS(=O)(=O)O)N

InChI

InChI=1S/C11H17N3O7S2/c1-7(12)6-8-2-3-9(14(15)16)10(13)11(8)22(17,18)4-5-23(19,20)21/h2-3,7H,4-6,12-13H2,1H3,(H,19,20,21)