2-[[2-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methylamino]-4-nitro-phenyl]amino]ethanol

Systemtic Name: 2-[[2-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methylamino]-4-nitro-phenyl]amino]ethanol Openeye Name: 2-[2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylamino]-4-nitro-anilino]ethanol CAS Name: 2-[2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylamino]-4-nitroanilino]ethanol IUPAC Name: 2-[2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylamino]-4-nitroanilino]ethanol Traditional Name: 2-[2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylamino]-4-nitro-anilino]ethanol Formula: C17H18ClN3O5 MolecularWeight: 379.79492

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)CNC3=C(C=CC(=C3)[N+](=O)[O-])NCCO)Cl

Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)CNC3=C(C=CC(=C3)[N+](=O)[O-])NCCO)Cl

InChI

InChI=1S/C17H18ClN3O5/c18-13-5-11(17-12(6-13)9-25-10-26-17)8-20-16-7-14(21(23)24)1-2-15(16)19-3-4-22/h1-2,5-7,19-20,22H,3-4,8-10H2