N-[[2-(dimethylaminomethyl)phenyl]methyl]-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide

Systemtic Name: N-[[2-(dimethylaminomethyl)phenyl]methyl]-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide Openeye Name: N-[[2-(dimethylaminomethyl)phenyl]methyl]-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide CAS Name: N-[[2-(dimethylaminomethyl)phenyl]methyl]-6-nitro-2,3-dihydro-1,4-benzodioxin-7-carboxamide IUPAC Name: N-[[2-(dimethylaminomethyl)phenyl]methyl]-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide Traditional Name: N-[2-(dimethylaminomethyl)benzyl]-6-nitro-2,3-dihydro-1,4-benzodioxin-7-carboxamide Formula: C19H21N3O5 MolecularWeight: 371.38714

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC=CC=C1CNC(=O)C2=CC3=C(C=C2[N+](=O)[O-])OCCO3

Isomeric SMILES

CN(C)CC1=CC=CC=C1CNC(=O)C2=CC3=C(C=C2[N+](=O)[O-])OCCO3

InChI

InChI=1S/C19H21N3O5/c1-21(2)12-14-6-4-3-5-13(14)11-20-19(23)15-9-17-18(27-8-7-26-17)10-16(15)22(24)25/h3-6,9-10H,7-8,11-12H2,1-2H3,(H,20,23)