(6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 2-azanyl-4-nitro-benzoate

Systemtic Name: (6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 2-azanyl-4-nitro-benzoate Openeye Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 2-amino-4-nitro-benzoate CAS Name: 2-amino-4-nitrobenzoic acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 2-amino-4-nitrobenzoate Traditional Name: 2-amino-4-nitro-benzoic acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C16H13ClN2O6 MolecularWeight: 364.73722

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13ClN2O6/c17-11-3-9-6-23-8-25-15(9)10(4-11)7-24-16(20)13-2-1-12(19(21)22)5-14(13)18/h1-5H,6-8,18H2