3-[[4-[bis(2-hydroxyethyl)amino]-2-nitro-phenyl]amino]propane-1,2-diol

Systemtic Name: 3-[[4-[bis(2-hydroxyethyl)amino]-2-nitro-phenyl]amino]propane-1,2-diol Openeye Name: 3-[4-[bis(2-hydroxyethyl)amino]-2-nitro-anilino]propane-1,2-diol CAS Name: 3-[4-[bis(2-hydroxyethyl)amino]-2-nitroanilino]propane-1,2-diol IUPAC Name: 3-[4-[bis(2-hydroxyethyl)amino]-2-nitroanilino]propane-1,2-diol Traditional Name: 3-[4-[bis(2-hydroxyethyl)amino]-2-nitro-anilino]propane-1,2-diol Formula: C13H21N3O6 MolecularWeight: 315.32234

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N(CCO)CCO)[N+](=O)[O-])NCC(CO)O

Isomeric SMILES

C1=CC(=C(C=C1N(CCO)CCO)[N+](=O)[O-])NCC(CO)O

InChI

InChI=1S/C13H21N3O6/c17-5-3-15(4-6-18)10-1-2-12(13(7-10)16(21)22)14-8-11(20)9-19/h1-2,7,11,14,17-20H,3-6,8-9H2