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

Systemtic Name: 3-[[7-[(2-chlorophenyl)methylamino]-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]propan-1-ol Openeye Name: 3-[[7-[(2-chlorophenyl)methylamino]-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]propan-1-ol CAS Name: 3-[[7-[(2-chlorophenyl)methylamino]-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]-1-propanol IUPAC Name: 3-[[7-[(2-chlorophenyl)methylamino]-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]propan-1-ol Traditional Name: 3-[[7-[(2-chlorobenzyl)amino]-4-nitro-benzofurazan-5-yl]amino]propan-1-ol Formula: C16H16ClN5O4 MolecularWeight: 377.78234

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16ClN5O4/c17-11-5-2-1-4-10(11)9-19-12-8-13(18-6-3-7-23)16(22(24)25)15-14(12)20-26-21-15/h1-2,4-5,8,18-19,23H,3,6-7,9H2