3-[[7-[(3-methoxyphenyl)amino]-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]propan-1-ol

Systemtic Name: 3-[[7-[(3-methoxyphenyl)amino]-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]propan-1-ol Openeye Name: 3-[[7-(3-methoxyanilino)-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]propan-1-ol CAS Name: 3-[[7-(3-methoxyanilino)-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]-1-propanol IUPAC Name: 3-[[7-(3-methoxyanilino)-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]propan-1-ol Traditional Name: 3-[[7-(m-anisidino)-4-nitro-benzofurazan-5-yl]amino]propan-1-ol Formula: C16H17N5O5 MolecularWeight: 359.33668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC2=CC(=C(C3=NON=C23)[N+](=O)[O-])NCCCO

Isomeric SMILES

COC1=CC=CC(=C1)NC2=CC(=C(C3=NON=C23)[N+](=O)[O-])NCCCO

InChI

InChI=1S/C16H17N5O5/c1-25-11-5-2-4-10(8-11)18-12-9-13(17-6-3-7-22)16(21(23)24)15-14(12)19-26-20-15/h2,4-5,8-9,17-18,22H,3,6-7H2,1H3