3-[[4-(2-hydroxyethylamino)-3-nitro-phenyl]-(3-oxidanylpropyl)amino]propan-1-ol hydrochloride

Systemtic Name: 3-[[4-(2-hydroxyethylamino)-3-nitro-phenyl]-(3-oxidanylpropyl)amino]propan-1-ol hydrochloride Openeye Name: 3-[4-(2-hydroxyethylamino)-N-(3-hydroxypropyl)-3-nitro-anilino]propan-1-ol hydrochloride CAS Name: 3-[4-(2-hydroxyethylamino)-N-(3-hydroxypropyl)-3-nitroanilino]-1-propanol hydrochloride IUPAC Name: 3-[4-(2-hydroxyethylamino)-N-(3-hydroxypropyl)-3-nitroanilino]propan-1-ol hydrochloride Traditional Name: 3-[4-(2-hydroxyethylamino)-N-(3-hydroxypropyl)-3-nitro-anilino]propan-1-ol hydrochloride Formula: C14H24ClN3O5 MolecularWeight: 349.81046

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N(CCCO)CCCO)[N+](=O)[O-])NCCO.Cl

Isomeric SMILES

C1=CC(=C(C=C1N(CCCO)CCCO)[N+](=O)[O-])NCCO.Cl

InChI

InChI=1S/C14H23N3O5.ClH/c18-8-1-6-16(7-2-9-19)12-3-4-13(15-5-10-20)14(11-12)17(21)22;/h3-4,11,15,18-20H,1-2,5-10H2;1H