(6-bromanyl-1,3-benzodioxol-5-yl)methyl 3-(aminocarbonylamino)benzoate

Systemtic Name: (6-bromanyl-1,3-benzodioxol-5-yl)methyl 3-(aminocarbonylamino)benzoate Openeye Name: (6-bromo-1,3-benzodioxol-5-yl)methyl 3-ureidobenzoate CAS Name: 3-(carbamoylamino)benzoic acid (6-bromo-1,3-benzodioxol-5-yl)methyl ester IUPAC Name: (6-bromo-1,3-benzodioxol-5-yl)methyl 3-(carbamoylamino)benzoate Traditional Name: 3-ureidobenzoic acid (6-bromo-1,3-benzodioxol-5-yl)methyl ester Formula: C16H13BrN2O5 MolecularWeight: 393.18882

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)COC(=O)C3=CC(=CC=C3)NC(=O)N)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)COC(=O)C3=CC(=CC=C3)NC(=O)N)Br

InChI

InChI=1S/C16H13BrN2O5/c17-12-6-14-13(23-8-24-14)5-10(12)7-22-15(20)9-2-1-3-11(4-9)19-16(18)21/h1-6H,7-8H2,(H3,18,19,21)