2-[3-azanyl-4-[[4-(2-hydroxyethylsulfonyl)-2-nitro-phenyl]amino]phenyl]sulfonylethanol

Systemtic Name: 2-[3-azanyl-4-[[4-(2-hydroxyethylsulfonyl)-2-nitro-phenyl]amino]phenyl]sulfonylethanol Openeye Name: 2-[3-amino-4-[4-(2-hydroxyethylsulfonyl)-2-nitro-anilino]phenyl]sulfonylethanol CAS Name: 2-[3-amino-4-[4-(2-hydroxyethylsulfonyl)-2-nitroanilino]phenyl]sulfonylethanol IUPAC Name: 2-[3-amino-4-[4-(2-hydroxyethylsulfonyl)-2-nitroanilino]phenyl]sulfonylethanol Traditional Name: 2-[3-amino-4-[4-(2-hydroxyethylsulfonyl)-2-nitro-anilino]phenyl]sulfonylethanol Formula: C16H19N3O8S2 MolecularWeight: 445.46736

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)(=O)CCO)N)NC2=C(C=C(C=C2)S(=O)(=O)CCO)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1S(=O)(=O)CCO)N)NC2=C(C=C(C=C2)S(=O)(=O)CCO)[N+](=O)[O-]

InChI

InChI=1S/C16H19N3O8S2/c17-13-9-11(28(24,25)7-5-20)1-3-14(13)18-15-4-2-12(10-16(15)19(22)23)29(26,27)8-6-21/h1-4,9-10,18,20-21H,5-8,17H2