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

Systemtic Name: 6-nitro-N-(3-phenylmethoxypropyl)-2,3-dihydro-1,4-benzodioxine-7-carboxamide Openeye Name: N-(3-benzyloxypropyl)-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide CAS Name: 6-nitro-N-(3-phenylmethoxypropyl)-2,3-dihydro-1,4-benzodioxin-7-carboxamide IUPAC Name: 6-nitro-N-(3-phenylmethoxypropyl)-2,3-dihydro-1,4-benzodioxine-7-carboxamide Traditional Name: N-(3-benzoxypropyl)-6-nitro-2,3-dihydro-1,4-benzodioxin-7-carboxamide Formula: C19H20N2O6 MolecularWeight: 372.3719

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C(=C2)[N+](=O)[O-])C(=O)NCCCOCC3=CC=CC=C3

Isomeric SMILES

C1COC2=C(O1)C=C(C(=C2)[N+](=O)[O-])C(=O)NCCCOCC3=CC=CC=C3

InChI

InChI=1S/C19H20N2O6/c22-19(20-7-4-8-25-13-14-5-2-1-3-6-14)15-11-17-18(27-10-9-26-17)12-16(15)21(23)24/h1-3,5-6,11-12H,4,7-10,13H2,(H,20,22)