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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC2=CC(=C(C3=NON=C23)[N+](=O)[O-])NCCCO

Isomeric SMILES

COC1=CC=C(C=C1)CNC2=CC(=C(C3=NON=C23)[N+](=O)[O-])NCCCO

InChI

InChI=1S/C17H19N5O5/c1-26-12-5-3-11(4-6-12)10-19-13-9-14(18-7-2-8-23)17(22(24)25)16-15(13)20-27-21-16/h3-6,9,18-19,23H,2,7-8,10H2,1H3