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

Systemtic Name: N-(4-butan-2-ylphenyl)-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide Openeye Name: 6-nitro-N-(4-sec-butylphenyl)-2,3-dihydro-1,4-benzodioxine-7-carboxamide CAS Name: N-(4-butan-2-ylphenyl)-6-nitro-2,3-dihydro-1,4-benzodioxin-7-carboxamide IUPAC Name: N-(4-butan-2-ylphenyl)-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide Traditional Name: 6-nitro-N-(4-sec-butylphenyl)-2,3-dihydro-1,4-benzodioxin-7-carboxamide Formula: C19H20N2O5 MolecularWeight: 356.3725

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20N2O5/c1-3-12(2)13-4-6-14(7-5-13)20-19(22)15-10-17-18(26-9-8-25-17)11-16(15)21(23)24/h4-7,10-12H,3,8-9H2,1-2H3,(H,20,22)