(6-nitro-1,3-benzodioxol-5-yl)methyl N-(pyridin-4-ylcarbonylamino)carbamate

Systemtic Name: (6-nitro-1,3-benzodioxol-5-yl)methyl N-(pyridin-4-ylcarbonylamino)carbamate Openeye Name: (6-nitro-1,3-benzodioxol-5-yl)methyl N-(pyridine-4-carbonylamino)carbamate CAS Name: N-[[oxo(pyridin-4-yl)methyl]amino]carbamic acid (6-nitro-1,3-benzodioxol-5-yl)methyl ester IUPAC Name: (6-nitro-1,3-benzodioxol-5-yl)methyl N-(pyridine-4-carbonylamino)carbamate Traditional Name: N-isonicotinamidocarbamic acid (6-nitro-1,3-benzodioxol-5-yl)methyl ester Formula: C15H12N4O7 MolecularWeight: 360.27838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)COC(=O)NNC(=O)C3=CC=NC=C3)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)COC(=O)NNC(=O)C3=CC=NC=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H12N4O7/c20-14(9-1-3-16-4-2-9)17-18-15(21)24-7-10-5-12-13(26-8-25-12)6-11(10)19(22)23/h1-6H,7-8H2,(H,17,20)(H,18,21)