(6-nitro-4H-1,3-benzodioxin-8-yl)methyl 3-(aminocarbonylamino)benzoate

Systemtic Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 3-(aminocarbonylamino)benzoate Openeye Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 3-ureidobenzoate CAS Name: 3-(carbamoylamino)benzoic acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 3-(carbamoylamino)benzoate Traditional Name: 3-ureidobenzoic acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C17H15N3O7 MolecularWeight: 373.3169

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15N3O7/c18-17(22)19-13-3-1-2-10(4-13)16(21)26-8-12-6-14(20(23)24)5-11-7-25-9-27-15(11)12/h1-6H,7-9H2,(H3,18,19,22)