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

Systemtic Name: 3-[[7-[(4-ethoxyphenyl)amino]-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]propan-1-ol Openeye Name: 3-[[7-(4-ethoxyanilino)-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]propan-1-ol CAS Name: 3-[[7-(4-ethoxyanilino)-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]-1-propanol IUPAC Name: 3-[[7-(4-ethoxyanilino)-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]propan-1-ol Traditional Name: 3-[[4-nitro-7-(p-phenetidino)benzofurazan-5-yl]amino]propan-1-ol Formula: C17H19N5O5 MolecularWeight: 373.36326

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC2=CC(=C(C3=NON=C23)[N+](=O)[O-])NCCCO

Isomeric SMILES

CCOC1=CC=C(C=C1)NC2=CC(=C(C3=NON=C23)[N+](=O)[O-])NCCCO

InChI

InChI=1S/C17H19N5O5/c1-2-26-12-6-4-11(5-7-12)19-13-10-14(18-8-3-9-23)17(22(24)25)16-15(13)20-27-21-16/h4-7,10,18-19,23H,2-3,8-9H2,1H3