(6-nitro-1,3-benzodioxol-5-yl)methyl N-(2-thiophen-3-ylethanoylamino)carbamate

Systemtic Name: (6-nitro-1,3-benzodioxol-5-yl)methyl N-(2-thiophen-3-ylethanoylamino)carbamate Openeye Name: (6-nitro-1,3-benzodioxol-5-yl)methyl N-[[2-(3-thienyl)acetyl]amino]carbamate CAS Name: N-[[1-oxo-2-(3-thiophenyl)ethyl]amino]carbamic acid (6-nitro-1,3-benzodioxol-5-yl)methyl ester IUPAC Name: (6-nitro-1,3-benzodioxol-5-yl)methyl N-[(2-thiophen-3-ylacetyl)amino]carbamate Traditional Name: N-[[2-(3-thienyl)acetyl]amino]carbamic acid (6-nitro-1,3-benzodioxol-5-yl)methyl ester Formula: C15H13N3O7S MolecularWeight: 379.34462

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)COC(=O)NNC(=O)CC3=CSC=C3)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)COC(=O)NNC(=O)CC3=CSC=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H13N3O7S/c19-14(3-9-1-2-26-7-9)16-17-15(20)23-6-10-4-12-13(25-8-24-12)5-11(10)18(21)22/h1-2,4-5,7H,3,6,8H2,(H,16,19)(H,17,20)