N-[2-[di(propan-2-yl)amino]ethyl]-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide

Systemtic Name: N-[2-[di(propan-2-yl)amino]ethyl]-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide Openeye Name: N-[2-(diisopropylamino)ethyl]-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide CAS Name: N-[2-[di(propan-2-yl)amino]ethyl]-6-nitro-2,3-dihydro-1,4-benzodioxin-7-carboxamide IUPAC Name: N-[2-[di(propan-2-yl)amino]ethyl]-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide Traditional Name: N-[2-(diisopropylamino)ethyl]-6-nitro-2,3-dihydro-1,4-benzodioxin-7-carboxamide Formula: C17H25N3O5 MolecularWeight: 351.3975

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCNC(=O)C1=CC2=C(C=C1[N+](=O)[O-])OCCO2)C(C)C

Isomeric SMILES

CC(C)N(CCNC(=O)C1=CC2=C(C=C1[N+](=O)[O-])OCCO2)C(C)C

InChI

InChI=1S/C17H25N3O5/c1-11(2)19(12(3)4)6-5-18-17(21)13-9-15-16(25-8-7-24-15)10-14(13)20(22)23/h9-12H,5-8H2,1-4H3,(H,18,21)