N-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide

Systemtic Name: N-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide Openeye Name: N-[2-(cyclopropylamino)-2-oxo-ethyl]-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide CAS Name: N-[2-(cyclopropylamino)-2-oxoethyl]-6-nitro-2,3-dihydro-1,4-benzodioxin-7-carboxamide IUPAC Name: N-[2-(cyclopropylamino)-2-oxoethyl]-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide Traditional Name: N-[2-(cyclopropylamino)-2-keto-ethyl]-6-nitro-2,3-dihydro-1,4-benzodioxin-7-carboxamide Formula: C14H15N3O6 MolecularWeight: 321.2854

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)CNC(=O)C2=CC3=C(C=C2[N+](=O)[O-])OCCO3

Isomeric SMILES

C1CC1NC(=O)CNC(=O)C2=CC3=C(C=C2[N+](=O)[O-])OCCO3

InChI

InChI=1S/C14H15N3O6/c18-13(16-8-1-2-8)7-15-14(19)9-5-11-12(23-4-3-22-11)6-10(9)17(20)21/h5-6,8H,1-4,7H2,(H,15,19)(H,16,18)