N-(3,4-dimethylphenyl)-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide

Systemtic Name: N-(3,4-dimethylphenyl)-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide Openeye Name: N-(3,4-dimethylphenyl)-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide CAS Name: N-(3,4-dimethylphenyl)-6-nitro-2,3-dihydro-1,4-benzodioxin-7-carboxamide IUPAC Name: N-(3,4-dimethylphenyl)-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide Traditional Name: N-(3,4-dimethylphenyl)-6-nitro-2,3-dihydro-1,4-benzodioxin-7-carboxamide Formula: C17H16N2O5 MolecularWeight: 328.31934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC3=C(C=C2[N+](=O)[O-])OCCO3)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC3=C(C=C2[N+](=O)[O-])OCCO3)C

InChI

InChI=1S/C17H16N2O5/c1-10-3-4-12(7-11(10)2)18-17(20)13-8-15-16(24-6-5-23-15)9-14(13)19(21)22/h3-4,7-9H,5-6H2,1-2H3,(H,18,20)