3-[[3-[bis(2-hydroxyethyl)amino]-2-nitro-phenyl]amino]propan-1-ol

Systemtic Name: 3-[[3-[bis(2-hydroxyethyl)amino]-2-nitro-phenyl]amino]propan-1-ol Openeye Name: 3-[3-[bis(2-hydroxyethyl)amino]-2-nitro-anilino]propan-1-ol CAS Name: 3-[3-[bis(2-hydroxyethyl)amino]-2-nitroanilino]-1-propanol IUPAC Name: 3-[3-[bis(2-hydroxyethyl)amino]-2-nitroanilino]propan-1-ol Traditional Name: 3-[3-[bis(2-hydroxyethyl)amino]-2-nitro-anilino]propan-1-ol Formula: C13H21N3O5 MolecularWeight: 299.32294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)N(CCO)CCO)[N+](=O)[O-])NCCCO

Isomeric SMILES

C1=CC(=C(C(=C1)N(CCO)CCO)[N+](=O)[O-])NCCCO

InChI

InChI=1S/C13H21N3O5/c17-8-2-5-14-11-3-1-4-12(13(11)16(20)21)15(6-9-18)7-10-19/h1,3-4,14,17-19H,2,5-10H2